6-ethyl-8-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: 6-ethyl-8-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: 6-ethyl-8-methyl-N-tetralin-1-yl-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: 6-ethyl-8-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: 6-ethyl-8-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: 6-ethyl-8-methyl-N-tetralin-1-yl-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C27H26N2OS MolecularWeight: 426.57314

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=CC(=C2)C(=O)NC3CCCC4=CC=CC=C34)SC5=C1C=C(C=C5)C

Isomeric SMILES

CCC1=NC2=C(C=CC(=C2)C(=O)NC3CCCC4=CC=CC=C34)SC5=C1C=C(C=C5)C

InChI

InChI=1S/C27H26N2OS/c1-3-22-21-15-17(2)11-13-25(21)31-26-14-12-19(16-24(26)28-22)27(30)29-23-10-6-8-18-7-4-5-9-20(18)23/h4-5,7,9,11-16,23H,3,6,8,10H2,1-2H3,(H,29,30)