Vitas-M small molecule compound
N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanamide
Catalog ID
STK835911
SMILES CCc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)Nc1c(C)n(n(c1=O)c1ccccc1)C
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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 C27H28N4O3S2 MW 520.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O3S2/c1-4-19-12-14-20(15-13-19)17-22-25(33)30(27(35)36-22)16-8-11-23(32)28-24-18(2)29(3)31(26(24)34)21-9-6-5-7-10-21/h5-7,9-10,12-15,17H,4,8,11,16H2,1-3H3,(H,28,32)/b22-17-InChIKey
CWRHDGCZMHANGT-XLNRJJMWSA-NSynonyms
315243-66-4(Z)N(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)4(5(4ethylbenzylidene)4oxo2thioxothiazolidin3yl)butanamide
315243664
CCC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C
CCc1ccc(cc1)C=C1SC(=S)N(C1=O)CCCC(=O)Nc1c(C)n(n(c1=O)c1ccccc1)C
InChI=1SC27H28N4O3S2c1419121420(151319)172225(33)30(27(35)3622)1681123(32)282418(2)29(3)31(26(24)34)2196571021h57910121517H481116H213H3(H2832)b2217
MFCD01950921
N(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)4((5Z)5(4ethylbenzylidene)4oxo2thioxo13thiazolidin3yl)butanamide
N(15DIMETHYL3OXO2PHENYLPYRAZOL4YL)4((5Z)5((4ETHYLPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANAMIDE
N(23DIMETHYL5OXO1PHENYL(3PYRAZOLIN4YL))4(5((4ETHYLPHENYL)METHYLENE)4OXO2THIOXO(13THIAZOLIDIN3YL))BUTANAMIDE
ZINC000013774172
ZINC13774172
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