3-cyclopentyl-N-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-2-yl)propanamide

Systemtic Name: 3-cyclopentyl-N-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-2-yl)propanamide Openeye Name: 3-cyclopentyl-N-(5-methyl-6-oxo-benzo[b][1,4]benzothiazepin-2-yl)propanamide CAS Name: 3-cyclopentyl-N-(5-methyl-6-oxo-2-benzo[b][1,4]benzothiazepinyl)propanamide IUPAC Name: 3-cyclopentyl-N-(5-methyl-6-oxobenzo[b][1,4]benzothiazepin-2-yl)propanamide Traditional Name: 3-cyclopentyl-N-(6-keto-5-methyl-benzo[b][1,4]benzothiazepin-2-yl)propionamide Formula: C22H24N2O2S MolecularWeight: 380.50316

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)CCC3CCCC3)SC4=CC=CC=C4C1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)CCC3CCCC3)SC4=CC=CC=C4C1=O

InChI

InChI=1S/C22H24N2O2S/c1-24-18-12-11-16(23-21(25)13-10-15-6-2-3-7-15)14-20(18)27-19-9-5-4-8-17(19)22(24)26/h4-5,8-9,11-12,14-15H,2-3,6-7,10,13H2,1H3,(H,23,25)