Vitas-M small molecule compound
4-{4-[(Z)-(3-hexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-1-phenyl-1H-pyrazol-3-yl}-N,N-dimethylbenzenesulfonamide
Catalog ID
STK809369
SMILES CCCCCCN1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2)S(=O)(=O)N(C)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 C27H30N4O3S3 MW 554.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O3S3/c1-4-5-6-10-17-30-26(32)24(36-27(30)35)18-21-19-31(22-11-8-7-9-12-22)28-25(21)20-13-15-23(16-14-20)37(33,34)29(2)3/h7-9,11-16,18-19H,4-6,10,17H2,1-3H3/b24-18-InChIKey
DOYBGECULSFSQA-MOHJPFBDSA-NSynonyms
4(4((Z)(3HEXYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)1PHENYLPYRAZOL3YL)NNDIMETHYLBENZENESULFONAMIDE
4(4((Z)(3hexyl4oxo2thioxo13thiazolidin5ylidene)methyl)1phenyl1Hpyrazol3yl)NNdimethylbenzenesulfonamide
CCCCCCN1C(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)S(=O)(=O)N(C)C)C4=CC=CC=C4)SC1=S
CCCCCCN1C(=S)SC(=Cc2cn(nc2c2ccc(cc2)S(=O)(=O)N(C)C)c2ccccc2)C1=O
InChI=1SC27H30N4O3S3c145610173026(32)24(3627(30)35)18211931(22118791222)2825(21)20131523(161420)37(3334)29(2)3h7911161819H461017H213H3b2418
MFCD03461338
ZINC000100833682
ZINC100833682
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