N-cyclopentyl-4-(6-oxidanylidenepyrido[2,3-b][1,4]benzothiazepin-5-yl)butanamide

Systemtic Name: N-cyclopentyl-4-(6-oxidanylidenepyrido[2,3-b][1,4]benzothiazepin-5-yl)butanamide Openeye Name: N-cyclopentyl-4-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5-yl)butanamide CAS Name: N-cyclopentyl-4-(6-oxo-5-pyrido[2,3-b][1,4]benzothiazepinyl)butanamide IUPAC Name: N-cyclopentyl-4-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5-yl)butanamide Traditional Name: N-cyclopentyl-4-(6-ketopyrido[2,3-b][1,4]benzothiazepin-5-yl)butyramide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)CCCN2C3=C(N=CC=C3)SC4=CC=CC=C4C2=O

Isomeric SMILES

C1CCC(C1)NC(=O)CCCN2C3=C(N=CC=C3)SC4=CC=CC=C4C2=O

InChI

InChI=1S/C21H23N3O2S/c25-19(23-15-7-1-2-8-15)12-6-14-24-17-10-5-13-22-20(17)27-18-11-4-3-9-16(18)21(24)26/h3-5,9-11,13,15H,1-2,6-8,12,14H2,(H,23,25)