methyl 4-methyl-2-[(4-methyl-3-nitro-phenyl)carbonylamino]-5-[(phenylmethyl)carbamoyl]thiophene-3-carboxylate

Systemtic Name: methyl 4-methyl-2-[(4-methyl-3-nitro-phenyl)carbonylamino]-5-[(phenylmethyl)carbamoyl]thiophene-3-carboxylate Openeye Name: methyl 5-(benzylcarbamoyl)-4-methyl-2-[(4-methyl-3-nitro-benzoyl)amino]thiophene-3-carboxylate CAS Name: 4-methyl-2-[[(4-methyl-3-nitrophenyl)-oxomethyl]amino]-5-[oxo-[(phenylmethyl)amino]methyl]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(benzylcarbamoyl)-4-methyl-2-[(4-methyl-3-nitrobenzoyl)amino]thiophene-3-carboxylate Traditional Name: 5-(benzylcarbamoyl)-4-methyl-2-[(4-methyl-3-nitro-benzoyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C23H21N3O6S MolecularWeight: 467.49434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C(C(=C(S2)C(=O)NCC3=CC=CC=C3)C)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(C(=C(S2)C(=O)NCC3=CC=CC=C3)C)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O6S/c1-13-9-10-16(11-17(13)26(30)31)20(27)25-22-18(23(29)32-3)14(2)19(33-22)21(28)24-12-15-7-5-4-6-8-15/h4-11H,12H2,1-3H3,(H,24,28)(H,25,27)