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

Systemtic Name: methyl 2-(butanoylamino)-4-methyl-5-[(3-methylphenyl)carbamoyl]thiophene-3-carboxylate Openeye Name: methyl 2-(butanoylamino)-4-methyl-5-(m-tolylcarbamoyl)thiophene-3-carboxylate CAS Name: 4-methyl-5-[(3-methylanilino)-oxomethyl]-2-(1-oxobutylamino)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(butanoylamino)-4-methyl-5-[(3-methylphenyl)carbamoyl]thiophene-3-carboxylate Traditional Name: 2-butyramido-4-methyl-5-(m-tolylcarbamoyl)thiophene-3-carboxylic acid methyl ester Formula: C19H22N2O4S MolecularWeight: 374.45398

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C(=C(S1)C(=O)NC2=CC=CC(=C2)C)C)C(=O)OC

Isomeric SMILES

CCCC(=O)NC1=C(C(=C(S1)C(=O)NC2=CC=CC(=C2)C)C)C(=O)OC

InChI

InChI=1S/C19H22N2O4S/c1-5-7-14(22)21-18-15(19(24)25-4)12(3)16(26-18)17(23)20-13-9-6-8-11(2)10-13/h6,8-10H,5,7H2,1-4H3,(H,20,23)(H,21,22)