methyl 2-(butanoylamino)-4-methyl-5-(1-phenylethylcarbamoyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-(butanoylamino)-4-methyl-5-(1-phenylethylcarbamoyl)thiophene-3-carboxylate Openeye Name: methyl 2-(butanoylamino)-4-methyl-5-(1-phenylethylcarbamoyl)thiophene-3-carboxylate CAS Name: 4-methyl-2-(1-oxobutylamino)-5-[oxo-(1-phenylethylamino)methyl]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(butanoylamino)-4-methyl-5-(1-phenylethylcarbamoyl)thiophene-3-carboxylate Traditional Name: 2-butyramido-4-methyl-5-(1-phenylethylcarbamoyl)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)NC(C)C2=CC=CC=C2)C)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O4S/c1-5-9-15(23)22-19-16(20(25)26-4)12(2)17(27-19)18(24)21-13(3)14-10-7-6-8-11-14/h6-8,10-11,13H,5,9H2,1-4H3,(H,21,24)(H,22,23)