9-methyl-6-phenyl-11-(phenylmethyl)-6,8,9,10-tetrahydrobenzo[c][1,5]benzothiazepin-7-one

Systemtic Name: 9-methyl-6-phenyl-11-(phenylmethyl)-6,8,9,10-tetrahydrobenzo[c][1,5]benzothiazepin-7-one Openeye Name: 11-benzyl-9-methyl-6-phenyl-6,8,9,10-tetrahydrobenzo[c][1,5]benzothiazepin-7-one CAS Name: 9-methyl-6-phenyl-11-(phenylmethyl)-6,8,9,10-tetrahydrobenzo[c][1,5]benzothiazepin-7-one IUPAC Name: 11-benzyl-9-methyl-6-phenyl-6,8,9,10-tetrahydrobenzo[c][1,5]benzothiazepin-7-one Traditional Name: 11-benzyl-9-methyl-6-phenyl-6,8,9,10-tetrahydrobenzo[c][1,5]benzothiazepin-7-one Formula: C27H25NOS MolecularWeight: 411.5585

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C(SC3=CC=CC=C3N2CC4=CC=CC=C4)C5=CC=CC=C5)C(=O)C1

Isomeric SMILES

CC1CC2=C(C(SC3=CC=CC=C3N2CC4=CC=CC=C4)C5=CC=CC=C5)C(=O)C1

InChI

InChI=1S/C27H25NOS/c1-19-16-23-26(24(29)17-19)27(21-12-6-3-7-13-21)30-25-15-9-8-14-22(25)28(23)18-20-10-4-2-5-11-20/h2-15,19,27H,16-18H2,1H3