2-(4-oxidanylidene-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl)-N-phenethyl-ethanamide

Systemtic Name: 2-(4-oxidanylidene-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl)-N-phenethyl-ethanamide Openeye Name: 2-(4-oxo-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl)-N-phenethyl-acetamide CAS Name: 2-(4-oxo-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl)-N-phenethylacetamide IUPAC Name: 2-(4-oxo-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl)-N-phenethylacetamide Traditional Name: 2-(4-keto-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl)-N-phenethyl-acetamide Formula: C25H24N2O2S MolecularWeight: 416.53526

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC2=CC=CC=C2N(C1=O)CC(=O)NCCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1C(SC2=CC=CC=C2N(C1=O)CC(=O)NCCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H24N2O2S/c28-24(26-16-15-19-9-3-1-4-10-19)18-27-21-13-7-8-14-22(21)30-23(17-25(27)29)20-11-5-2-6-12-20/h1-14,23H,15-18H2,(H,26,28)