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

Systemtic Name: methyl 2-(butanoylamino)-5-[(2,3-dimethylphenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-(butanoylamino)-5-[(2,3-dimethylphenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate CAS Name: 5-[(2,3-dimethylanilino)-oxomethyl]-4-methyl-2-(1-oxobutylamino)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(butanoylamino)-5-[(2,3-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate Traditional Name: 2-butyramido-5-[(2,3-dimethylphenyl)carbamoyl]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C(=C(S1)C(=O)NC2=CC=CC(=C2C)C)C)C(=O)OC

Isomeric SMILES

CCCC(=O)NC1=C(C(=C(S1)C(=O)NC2=CC=CC(=C2C)C)C)C(=O)OC

InChI

InChI=1S/C20H24N2O4S/c1-6-8-15(23)22-19-16(20(25)26-5)13(4)17(27-19)18(24)21-14-10-7-9-11(2)12(14)3/h7,9-10H,6,8H2,1-5H3,(H,21,24)(H,22,23)