Vitas-M small molecule compound
ethyl 2-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamothioyl]amino}-5-phenylthiophene-3-carboxylate
Catalog ID
STK456467
SMILES CCOC(=O)c1cc(sc1NC(=S)Nc1c(=O)n(n(c1C)C)c1ccccc1)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 C25H24N4O3S2 MW 492.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O3S2/c1-4-32-24(31)19-15-20(17-11-7-5-8-12-17)34-22(19)27-25(33)26-21-16(2)28(3)29(23(21)30)18-13-9-6-10-14-18/h5-15H,4H2,1-3H3,(H2,26,27,33)InChIKey
YGEBKTMDKZNVBN-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C
ETHYL2((((23DIMETHYL5OXO1PHENYL(3PYRAZOLIN4YL))AMINO)THIOXOMETHYL)AMINO)5PHENYLTHIOPHENE3CARBOXYLATE
ethyl2(((15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)carbamothioyl)amino)5phenylthiophene3carboxylate
ETHYL2((15DIMETHYL3OXO2PHENYLPYRAZOL4YL)CARBAMOTHIOYLAMINO)5PHENYLTHIOPHENE3CARBOXYLATE
InChI=1SC25H24N4O3S2c143224(31)191520(17117581217)3422(19)2725(33)262116(2)28(3)29(23(21)30)181396101418h515H4H213H3(H2262733)
MFCD05069063
ZINC000001121935
ZINC01121935
ZINC1121935
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