6,7,10-trimethyl-N-(phenylmethyl)benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: 6,7,10-trimethyl-N-(phenylmethyl)benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: N-benzyl-6,7,10-trimethyl-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: 6,7,10-trimethyl-N-(phenylmethyl)-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: N-benzyl-6,7,10-trimethylbenzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: N-benzyl-6,7,10-trimethyl-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C24H22N2OS MolecularWeight: 386.50928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NC3=C(C=CC(=C3)C(=O)NCC4=CC=CC=C4)SC2=C(C=C1)C)C

Isomeric SMILES

CC1=C2C(=NC3=C(C=CC(=C3)C(=O)NCC4=CC=CC=C4)SC2=C(C=C1)C)C

InChI

InChI=1S/C24H22N2OS/c1-15-9-10-16(2)23-22(15)17(3)26-20-13-19(11-12-21(20)28-23)24(27)25-14-18-7-5-4-6-8-18/h4-13H,14H2,1-3H3,(H,25,27)