8-methyl-N-(phenylmethyl)-6-propyl-benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: 8-methyl-N-(phenylmethyl)-6-propyl-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: N-benzyl-8-methyl-6-propyl-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: 8-methyl-N-(phenylmethyl)-6-propyl-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: N-benzyl-8-methyl-6-propylbenzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: N-benzyl-8-methyl-6-propyl-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C25H24N2OS MolecularWeight: 400.53586

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=CC(=C2)C(=O)NCC3=CC=CC=C3)SC4=C1C=C(C=C4)C

Isomeric SMILES

CCCC1=NC2=C(C=CC(=C2)C(=O)NCC3=CC=CC=C3)SC4=C1C=C(C=C4)C

InChI

InChI=1S/C25H24N2OS/c1-3-7-21-20-14-17(2)10-12-23(20)29-24-13-11-19(15-22(24)27-21)25(28)26-16-18-8-5-4-6-9-18/h4-6,8-15H,3,7,16H2,1-2H3,(H,26,28)