Vitas-M small molecule compound

[(5Z)-4-oxo-5-{[1-phenyl-3-(3-propoxyphenyl)-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-3-yl]acetic acid

Catalog ID
STK707164
SMILES CCCOc1cccc(c1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CC(=O)O)c1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C24H21N3O4S2 MW 479.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O4S2/c1-2-11-31-19-10-6-7-16(12-19)22-17(14-27(25-22)18-8-4-3-5-9-18)13-20-23(30)26(15-21(28)29)24(32)33-20/h3-10,12-14H,2,11,15H2,1H3,(H,28,29)/b20-13-
InChIKey
VUENNZHZJKNGAS-MOSHPQCFSA-N
Synonyms

((5Z)4oxo5((1phenyl3(3propoxyphenyl)1Hpyrazol4yl)methylidene)2thioxo13thiazolidin3yl)aceticacid
(Z)2(4oxo5((1phenyl3(3propoxyphenyl)1Hpyrazol4yl)methylene)2thioxothiazolidin3yl)aceticacidcompoundwithaceticacid(11)
2((5Z)4OXO5((1PHENYL3(3PROPOXYPHENYL)PYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
CC(=O)OCCCOc1cccc(c1)c1nn(cc1C=C1SC(=S)N(C1=O)CC(=O)O)c1ccccc1
CCCOC1=CC=CC(=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC(=O)O)C4=CC=CC=C4
CCCOc1cccc(c1)c1nn(cc1C=C1SC(=S)N(C1=O)CC(=O)O)c1ccccc1
InChI=1SC24H21N3O4S2c12113119106716(1219)2217(1427(2522)188435918)132023(30)26(1521(28)29)24(32)3320h3101214H21115H21H3(H2829)b2013
MFCD04029057
ZINC000002386237
ZINC2386237

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Available files

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