Flow object JSON
{
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{
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],
"altLabel": [
{
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},
{
"@value": "2-([4-[(1,3-Thiazol-2-yl)sulfamoyl]phenyl]carbamoyl)benzoic acid",
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},
{
"@value": "2-(N4-Phthalylaminobenzenesulfonamide)thiazole",
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},
{
"@value": "2-(N4-Phthalylsulfanilamido)thiazole",
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},
{
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},
{
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},
{
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},
{
"@value": "2-{[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamoyl}benzoic Acid",
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},
{
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},
{
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},
{
"@value": "AFI-Ftalyl",
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},
{
"@value": "Benzoic acid, 2-[[[4-[(2-thiazolylamino)sulfonyl]phenyl]amino]carbonyl]-",
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},
{
"@value": "Cremothalidine",
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},
{
"@value": "Enteramida",
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},
{
"@value": "Entero-sulfina",
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},
{
"@value": "Entexidina",
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},
{
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},
{
"@value": "Ftalil-Esteve",
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},
{
"@value": "Ftalil-Septol",
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},
{
"@value": "ftalilsulfatiazol",
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},
{
"@value": "Ftalysept",
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},
{
"@value": "Intestiazol",
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},
{
"@value": "Phtalazol",
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},
{
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},
{
"@value": "Phthalanilic acid, 4′-(2-thiazolylsulfamoyl)-",
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},
{
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},
{
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},
{
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},
{
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{
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{
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{
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{
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{
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{
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{
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{
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{
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{
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{
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{
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{
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{
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{
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