ethyl 5-(cyclohexylcarbamoyl)-4-methyl-2-(2-phenylethanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 5-(cyclohexylcarbamoyl)-4-methyl-2-(2-phenylethanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-(cyclohexylcarbamoyl)-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate CAS Name: 5-[(cyclohexylamino)-oxomethyl]-4-methyl-2-[(1-oxo-2-phenylethyl)amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(cyclohexylcarbamoyl)-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate Traditional Name: 5-(cyclohexylcarbamoyl)-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C23H28N2O4S MolecularWeight: 428.54442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2CCCCC2)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2CCCCC2)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C23H28N2O4S/c1-3-29-23(28)19-15(2)20(21(27)24-17-12-8-5-9-13-17)30-22(19)25-18(26)14-16-10-6-4-7-11-16/h4,6-7,10-11,17H,3,5,8-9,12-14H2,1-2H3,(H,24,27)(H,25,26)