Vitas-M small molecule compound
[(5Z)-5-{[3-(3,4-dimethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
Catalog ID
STK880725
SMILES COc1cc(ccc1OC)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 C23H19N3O5S2 MW 481.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O5S2/c1-30-17-9-8-14(10-18(17)31-2)21-15(12-26(24-21)16-6-4-3-5-7-16)11-19-22(29)25(13-20(27)28)23(32)33-19/h3-12H,13H2,1-2H3,(H,27,28)/b19-11-InChIKey
RXMNDEUYTHNCRI-ODLFYWEKSA-NSynonyms
((5Z)5((3(34dimethoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
2((5Z)5((3(34DIMETHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
2(5((3(34DIMETHOXYPHENYL)1PHENYL1HPYRAZOL4YL)METHYLENE)4OXO2THIOXOTHIAZOLIDIN3YL)ACETICACID
COC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC(=O)O)C4=CC=CC=C4)OC
COc1cc(ccc1OC)c1nn(cc1C=C1SC(=S)N(C1=O)CC(=O)O)c1ccccc1
InChI=1SC23H19N3O5S2c130179814(1018(17)312)2115(1226(2421)166435716)111922(29)25(1320(27)28)23(32)3319h312H13H212H3(H2728)b1911
MFCD04441318
ZINC000013092543
ZINC13092543
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