N-[1-[(4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepin-7-yl)carbonyl]piperidin-4-yl]-3-phenyl-propanamide

Systemtic Name: N-[1-[(4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepin-7-yl)carbonyl]piperidin-4-yl]-3-phenyl-propanamide Openeye Name: N-[1-(4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carbonyl)-4-piperidyl]-3-phenyl-propanamide CAS Name: N-[1-[oxo-(4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-7-yl)methyl]-4-piperidinyl]-3-phenylpropanamide IUPAC Name: N-[1-(4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carbonyl)piperidin-4-yl]-3-phenylpropanamide Traditional Name: N-[1-(4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carbonyl)-4-piperidyl]-3-phenyl-propionamide Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)CCC2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)SCCC(=O)N4

Isomeric SMILES

C1CN(CCC1NC(=O)CCC2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)SCCC(=O)N4

InChI

InChI=1S/C24H27N3O3S/c28-22(9-6-17-4-2-1-3-5-17)25-19-10-13-27(14-11-19)24(30)18-7-8-21-20(16-18)26-23(29)12-15-31-21/h1-5,7-8,16,19H,6,9-15H2,(H,25,28)(H,26,29)