Vitas-M small molecule compound

dimethyl 5-({[3-(benzylcarbamoyl)phenyl]carbamothioyl}amino)-3-methylthiophene-2,4-dicarboxylate

Catalog ID
STK458232
SMILES COC(=O)c1c(NC(=S)Nc2cccc(c2)C(=O)NCc2ccccc2)sc(c1C)C(=O)OC

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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 C24H23N3O5S2 MW 497.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O5S2/c1-14-18(22(29)31-2)21(34-19(14)23(30)32-3)27-24(33)26-17-11-7-10-16(12-17)20(28)25-13-15-8-5-4-6-9-15/h4-12H,13H2,1-3H3,(H,25,28)(H2,26,27,33)
InChIKey
IQOMUSFIAKBJCC-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3=CC=CC=C3)C(=O)OC
dimethyl5(((3(benzylcarbamoyl)phenyl)carbamothioyl)amino)3methylthiophene24dicarboxylate
DIMETHYL5((3(BENZYLCARBAMOYL)PHENYL)CARBAMOTHIOYLAMINO)3METHYLTHIOPHENE24DICARBOXYLATE
InChI=1SC24H23N3O5S2c11418(22(29)312)21(3419(14)23(30)323)2724(33)26171171016(1217)20(28)2513158546915h412H13H213H3(H2528)(H2262733)
METHYL5(METHOXYCARBONYL)4METHYL2((((3(NBENZYLCARBAMOYL)PHENYL)AMINO)THIOXOMETHYL)AMINO)THIOPHENE3CARBOXYLATE
MFCD05138195
ZINC000002852668
ZINC02852668
ZINC2852668

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.