N-(1-naphthalen-1-ylethyl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: N-(1-naphthalen-1-ylethyl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-[1-(1-naphthyl)ethyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-[1-(1-naphthalenyl)ethyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-(1-naphthalen-1-ylethyl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: 4-keto-N-[1-(1-naphthyl)ethyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C22H20N2O2S MolecularWeight: 376.4714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C3=CC4=C(C=C3)SCCC(=O)N4

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C3=CC4=C(C=C3)SCCC(=O)N4

InChI

InChI=1S/C22H20N2O2S/c1-14(17-8-4-6-15-5-2-3-7-18(15)17)23-22(26)16-9-10-20-19(13-16)24-21(25)11-12-27-20/h2-10,13-14H,11-12H2,1H3,(H,23,26)(H,24,25)