N-cyclopentyl-6-oxidanylidene-5-prop-2-enyl-benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: N-cyclopentyl-6-oxidanylidene-5-prop-2-enyl-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: 5-allyl-N-cyclopentyl-6-oxo-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: N-cyclopentyl-6-oxo-5-prop-2-enyl-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: N-cyclopentyl-6-oxo-5-prop-2-enylbenzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: 5-allyl-N-cyclopentyl-6-keto-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C22H22N2O2S MolecularWeight: 378.48728

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(C=CC(=C2)C(=O)NC3CCCC3)SC4=CC=CC=C4C1=O

Isomeric SMILES

C=CCN1C2=C(C=CC(=C2)C(=O)NC3CCCC3)SC4=CC=CC=C4C1=O

InChI

InChI=1S/C22H22N2O2S/c1-2-13-24-18-14-15(21(25)23-16-7-3-4-8-16)11-12-20(18)27-19-10-6-5-9-17(19)22(24)26/h2,5-6,9-12,14,16H,1,3-4,7-8,13H2,(H,23,25)