3-(6-oxidanylidenepyrido[2,3-b][1,4]benzothiazepin-5-yl)-N-(4-propan-2-ylphenyl)propanamide

Systemtic Name: 3-(6-oxidanylidenepyrido[2,3-b][1,4]benzothiazepin-5-yl)-N-(4-propan-2-ylphenyl)propanamide Openeye Name: N-(4-isopropylphenyl)-3-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5-yl)propanamide CAS Name: 3-(6-oxo-5-pyrido[2,3-b][1,4]benzothiazepinyl)-N-(4-propan-2-ylphenyl)propanamide IUPAC Name: 3-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5-yl)-N-(4-propan-2-ylphenyl)propanamide Traditional Name: 3-(6-ketopyrido[2,3-b][1,4]benzothiazepin-5-yl)-N-p-cumenyl-propionamide Formula: C24H23N3O2S MolecularWeight: 417.52332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)CCN2C3=C(N=CC=C3)SC4=CC=CC=C4C2=O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)CCN2C3=C(N=CC=C3)SC4=CC=CC=C4C2=O

InChI

InChI=1S/C24H23N3O2S/c1-16(2)17-9-11-18(12-10-17)26-22(28)13-15-27-20-7-5-14-25-23(20)30-21-8-4-3-6-19(21)24(27)29/h3-12,14,16H,13,15H2,1-2H3,(H,26,28)