N-[1-(3,4-diethoxyphenyl)-2-methyl-propyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: N-[1-(3,4-diethoxyphenyl)-2-methyl-propyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-[1-(3,4-diethoxyphenyl)-2-methyl-propyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-[1-(3,4-diethoxyphenyl)-2-methylpropyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-[1-(3,4-diethoxyphenyl)-2-methylpropyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: N-[1-(3,4-diethoxyphenyl)-2-methyl-propyl]-4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C24H30N2O4S MolecularWeight: 442.571

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C(C)C)NC(=O)C2=CC3=C(C=C2)SCCC(=O)N3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C(C)C)NC(=O)C2=CC3=C(C=C2)SCCC(=O)N3)OCC

InChI

InChI=1S/C24H30N2O4S/c1-5-29-19-9-7-16(14-20(19)30-6-2)23(15(3)4)26-24(28)17-8-10-21-18(13-17)25-22(27)11-12-31-21/h7-10,13-15,23H,5-6,11-12H2,1-4H3,(H,25,27)(H,26,28)