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

Systemtic Name: methyl 2-(butanoylamino)-5-[(2-ethoxyphenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-(butanoylamino)-5-[(2-ethoxyphenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate CAS Name: 5-[(2-ethoxyanilino)-oxomethyl]-4-methyl-2-(1-oxobutylamino)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(butanoylamino)-5-[(2-ethoxyphenyl)carbamoyl]-4-methylthiophene-3-carboxylate Traditional Name: 2-butyramido-4-methyl-5-(o-phenetylcarbamoyl)thiophene-3-carboxylic acid methyl ester Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C(=C(S1)C(=O)NC2=CC=CC=C2OCC)C)C(=O)OC

Isomeric SMILES

CCCC(=O)NC1=C(C(=C(S1)C(=O)NC2=CC=CC=C2OCC)C)C(=O)OC

InChI

InChI=1S/C20H24N2O5S/c1-5-9-15(23)22-19-16(20(25)26-4)12(3)17(28-19)18(24)21-13-10-7-8-11-14(13)27-6-2/h7-8,10-11H,5-6,9H2,1-4H3,(H,21,24)(H,22,23)