5-[(2-chlorophenyl)methyl]-N-cyclopentyl-6-oxidanylidene-benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: 5-[(2-chlorophenyl)methyl]-N-cyclopentyl-6-oxidanylidene-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: 5-[(2-chlorophenyl)methyl]-N-cyclopentyl-6-oxo-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: 5-[(2-chlorophenyl)methyl]-N-cyclopentyl-6-oxo-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: 5-[(2-chlorophenyl)methyl]-N-cyclopentyl-6-oxobenzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: 5-(2-chlorobenzyl)-N-cyclopentyl-6-keto-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C26H23ClN2O2S MolecularWeight: 462.99102

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C2=CC3=C(C=C2)SC4=CC=CC=C4C(=O)N3CC5=CC=CC=C5Cl

Isomeric SMILES

C1CCC(C1)NC(=O)C2=CC3=C(C=C2)SC4=CC=CC=C4C(=O)N3CC5=CC=CC=C5Cl

InChI

InChI=1S/C26H23ClN2O2S/c27-21-11-5-1-7-18(21)16-29-22-15-17(25(30)28-19-8-2-3-9-19)13-14-24(22)32-23-12-6-4-10-20(23)26(29)31/h1,4-7,10-15,19H,2-3,8-9,16H2,(H,28,30)