ethyl 2-(cyclobutylcarbonylamino)-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate

Systemtic Name: ethyl 2-(cyclobutylcarbonylamino)-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate Openeye Name: ethyl 2-(cyclobutanecarbonylamino)-4-methyl-5-(o-tolylcarbamoyl)thiophene-3-carboxylate CAS Name: 2-[[cyclobutyl(oxo)methyl]amino]-4-methyl-5-[(2-methylanilino)-oxomethyl]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(cyclobutanecarbonylamino)-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate Traditional Name: 2-(cyclobutanecarbonylamino)-4-methyl-5-(o-tolylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2C)NC(=O)C3CCC3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2C)NC(=O)C3CCC3

InChI

InChI=1S/C21H24N2O4S/c1-4-27-21(26)16-13(3)17(19(25)22-15-11-6-5-8-12(15)2)28-20(16)23-18(24)14-9-7-10-14/h5-6,8,11,14H,4,7,9-10H2,1-3H3,(H,22,25)(H,23,24)