(6S,9S)-6-(2-chlorophenyl)-9-phenyl-8,9,10,11-tetrahydro-6H-benzo[c][1,5]benzothiazepin-7-one

Systemtic Name: (6S,9S)-6-(2-chlorophenyl)-9-phenyl-8,9,10,11-tetrahydro-6H-benzo[c][1,5]benzothiazepin-7-one Openeye Name: (6S,9S)-6-(2-chlorophenyl)-9-phenyl-8,9,10,11-tetrahydro-6H-benzo[c][1,5]benzothiazepin-7-one CAS Name: (6S,9S)-6-(2-chlorophenyl)-9-phenyl-8,9,10,11-tetrahydro-6H-benzo[c][1,5]benzothiazepin-7-one IUPAC Name: (6S,9S)-6-(2-chlorophenyl)-9-phenyl-8,9,10,11-tetrahydro-6H-benzo[c][1,5]benzothiazepin-7-one Traditional Name: (6S,9S)-6-(2-chlorophenyl)-9-phenyl-8,9,10,11-tetrahydro-6H-benzo[c][1,5]benzothiazepin-7-one Formula: C25H20ClNOS MolecularWeight: 417.9504

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)C2=C1NC3=CC=CC=C3SC2C4=CC=CC=C4Cl)C5=CC=CC=C5

Isomeric SMILES

C1[C@@H](CC(=O)C2=C1NC3=CC=CC=C3S[C@@H]2C4=CC=CC=C4Cl)C5=CC=CC=C5

InChI

InChI=1S/C25H20ClNOS/c26-19-11-5-4-10-18(19)25-24-21(27-20-12-6-7-13-23(20)29-25)14-17(15-22(24)28)16-8-2-1-3-9-16/h1-13,17,25,27H,14-15H2/t17-,25+/m0/s1