ethyl 4-methyl-2-[(2-methylphenyl)carbonylamino]-5-(phenethylcarbamoyl)thiophene-3-carboxylate

Systemtic Name: ethyl 4-methyl-2-[(2-methylphenyl)carbonylamino]-5-(phenethylcarbamoyl)thiophene-3-carboxylate Openeye Name: ethyl 4-methyl-2-[(2-methylbenzoyl)amino]-5-(phenethylcarbamoyl)thiophene-3-carboxylate CAS Name: 4-methyl-2-[[(2-methylphenyl)-oxomethyl]amino]-5-[oxo-(phenethylamino)methyl]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[(2-methylbenzoyl)amino]-5-(phenethylcarbamoyl)thiophene-3-carboxylate Traditional Name: 4-methyl-2-(o-toluoylamino)-5-(phenethylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C25H26N2O4S MolecularWeight: 450.54994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NCCC2=CC=CC=C2)NC(=O)C3=CC=CC=C3C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NCCC2=CC=CC=C2)NC(=O)C3=CC=CC=C3C

InChI

InChI=1S/C25H26N2O4S/c1-4-31-25(30)20-17(3)21(23(29)26-15-14-18-11-6-5-7-12-18)32-24(20)27-22(28)19-13-9-8-10-16(19)2/h5-13H,4,14-15H2,1-3H3,(H,26,29)(H,27,28)