Vitas-M small molecule compound
3-[(5Z)-5-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid
Catalog ID
STK706402
SMILES OC(=O)CCN1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2)C)c2ccccc2)/C1=O
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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 C23H19N3O3S2 MW 449.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O3S2/c1-15-7-9-16(10-8-15)21-17(14-26(24-21)18-5-3-2-4-6-18)13-19-22(29)25(23(30)31-19)12-11-20(27)28/h2-10,13-14H,11-12H2,1H3,(H,27,28)/b19-13-InChIKey
ZPMLJCGCTUVNQV-UYRXBGFRSA-NSynonyms
313273-14-2(Z)3(4oxo5((1phenyl3(ptolyl)1Hpyrazol4yl)methylene)2thioxothiazolidin3yl)propanoicacid
3((5Z)5((3(4methylphenyl)1phenyl1Hpyrazol4yl)methylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
3((5Z)5((3(4METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
313273142
CC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCC(=O)O)C4=CC=CC=C4
InChI=1SC23H19N3O3S2c1157916(10815)2117(1426(2421)185324618)131922(29)25(23(30)3119)121120(27)28h2101314H1112H21H3(H2728)b1913
MFCD01955029
OC(=O)CCN1C(=S)SC(=Cc2cn(nc2c2ccc(cc2)C)c2ccccc2)C1=O
ZINC000009335040
ZINC9335040
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