Vitas-M small molecule compound
4-({3-[(3-methylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}amino)-4-oxobutanoic acid
Catalog ID
STK475440
SMILES OC(=O)CCC(=O)Nc1sc2c(c1C(=O)Nc1cccc(c1)C)CCCC2
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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 C20H22N2O4S MW 386.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O4S/c1-12-5-4-6-13(11-12)21-19(26)18-14-7-2-3-8-15(14)27-20(18)22-16(23)9-10-17(24)25/h4-6,11H,2-3,7-10H2,1H3,(H,21,26)(H,22,23)(H,24,25)InChIKey
NRPJPBUQJVPFRL-UHFFFAOYSA-NSynonyms
4((3((3methylphenyl)carbamoyl)4567tetrahydro1benzothiophen2yl)amino)4oxobutanoicacid
CC1=CC(=CC=C1)NC(=O)C2=C(SC3=C2CCCC3)NC(=O)CCC(=O)O
InChI=1SC20H22N2O4Sc11254613(1112)2119(26)1814723815(14)2720(18)2216(23)91017(24)25h4611H23710H21H3(H2126)(H2223)(H2425)
MFCD01989484
ZINC000006698625
ZINC6698625
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