Vitas-M small molecule compound

methyl 5-carbamoyl-2-[(3,3-diphenylpropanoyl)amino]-4-methylthiophene-3-carboxylate

Catalog ID
STK448602
SMILES COC(=O)c1c(NC(=O)CC(c2ccccc2)c2ccccc2)sc(c1C)C(=O)N

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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 C23H22N2O4S MW 422.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O4S/c1-14-19(23(28)29-2)22(30-20(14)21(24)27)25-18(26)13-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17H,13H2,1-2H3,(H2,24,27)(H,25,26)
InChIKey
VRYQFQQZHIOVEF-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC)NC(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)N
InChI=1SC23H22N2O4Sc11419(23(28)292)22(3020(14)21(24)27)2518(26)1317(1595361015)16117481216h31217H13H212H3(H22427)(H2526)
METHYL2(33DIPHENYLPROPANOYLAMINO)5CARBAMOYL4METHYLTHIOPHENE3CARBOXYLATE
methyl5carbamoyl2((33diphenylpropanoyl)amino)4methylthiophene3carboxylate
methyl5carbamoyl2(33diphenylpropanoylamino)4methylthiophene3carboxylate
MFCD06067825
ZINC000017093126
ZINC17093126

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Available files

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