Vitas-M small molecule compound
methyl 4-methyl-2-{[(4-nitrophenyl)carbonyl]amino}-5-[(2-phenylethyl)carbamoyl]thiophene-3-carboxylate
Catalog ID
STK407108
SMILES COC(=O)c1c(NC(=O)c2ccc(cc2)[N+](=O)[O-])sc(c1C)C(=O)NCCc1ccccc1
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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 C23H21N3O6S MW 467.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O6S/c1-14-18(23(29)32-2)22(25-20(27)16-8-10-17(11-9-16)26(30)31)33-19(14)21(28)24-13-12-15-6-4-3-5-7-15/h3-11H,12-13H2,1-2H3,(H,24,28)(H,25,27)InChIKey
WGIUWXUGNXPQDQ-UHFFFAOYSA-NSynonyms
CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=C(C=C2)(N+)(=O)(O))C(=O)NCCC3=CC=CC=C3
COC(=O)c1c(NC(=O)c2ccc(cc2)(N+)(=O)(O))sc(c1C)C(=O)NCCc1ccccc1
InChI=1SC23H21N3O6Sc11418(23(29)322)22(2520(27)1681017(11916)26(30)31)3319(14)21(28)241312156435715h311H1213H212H3(H2428)(H2527)
methyl4methyl2(((4nitrophenyl)carbonyl)amino)5((2phenylethyl)carbamoyl)thiophene3carboxylate
METHYL4METHYL2((4NITROBENZOYL)AMINO)5((2PHENYLETHYL)CARBAMOYL)THIOPHENE3CARBOXYLATE
methyl4methyl2((4nitrobenzoyl)amino)5(2phenylethylcarbamoyl)thiophene3carboxylate
METHYL4METHYL2((4NITROBENZOYL)AMINO)5(PHENETHYLCARBAMOYL)THIOPHENE3CARBOXYLATE
METHYL4METHYL2((4NITROPHENYL)CARBONYLAMINO)5(N(2PHENYLETHYL)CARBAMOYL)THIOPHENE3CARBOXYLATE
MFCD06627704
ZINC000002880001
ZINC02880001
ZINC2880001
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Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.