butyl 2-(3-phenylpropanoylamino)-1-benzothiophene-3-carboxylate

Systemtic Name: butyl 2-(3-phenylpropanoylamino)-1-benzothiophene-3-carboxylate Openeye Name: butyl 2-(3-phenylpropanoylamino)benzothiophene-3-carboxylate CAS Name: 2-[(1-oxo-3-phenylpropyl)amino]-1-benzothiophene-3-carboxylic acid butyl ester IUPAC Name: butyl 2-(3-phenylpropanoylamino)-1-benzothiophene-3-carboxylate Traditional Name: 2-(hydrocinnamoylamino)benzothiophene-3-carboxylic acid butyl ester Formula: C22H23NO3S MolecularWeight: 381.48792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CCCCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C22H23NO3S/c1-2-3-15-26-22(25)20-17-11-7-8-12-18(17)27-21(20)23-19(24)14-13-16-9-5-4-6-10-16/h4-12H,2-3,13-15H2,1H3,(H,23,24)