5-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-one

Systemtic Name: 5-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-one Openeye Name: 5-[2-oxo-2-(1-piperidyl)ethyl]-2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-one CAS Name: 5-[2-oxo-2-(1-piperidinyl)ethyl]-2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-one IUPAC Name: 5-(2-oxo-2-piperidin-1-ylethyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-one Traditional Name: 5-(2-keto-2-piperidino-ethyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-one Formula: C22H24N2O2S MolecularWeight: 380.50316

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CN2C(=O)CC(SC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)CN2C(=O)CC(SC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C22H24N2O2S/c25-21-15-20(17-9-3-1-4-10-17)27-19-12-6-5-11-18(19)24(21)16-22(26)23-13-7-2-8-14-23/h1,3-6,9-12,20H,2,7-8,13-16H2