N-(2,3-dimethylcyclohexyl)-6,8-dimethyl-benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: N-(2,3-dimethylcyclohexyl)-6,8-dimethyl-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: N-(2,3-dimethylcyclohexyl)-6,8-dimethyl-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: N-(2,3-dimethylcyclohexyl)-6,8-dimethyl-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: N-(2,3-dimethylcyclohexyl)-6,8-dimethylbenzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: N-(2,3-dimethylcyclohexyl)-6,8-dimethyl-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C24H28N2OS MolecularWeight: 392.55692

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)C2=CC3=C(C=C2)SC4=C(C=C(C=C4)C)C(=N3)C

Isomeric SMILES

CC1CCCC(C1C)NC(=O)C2=CC3=C(C=C2)SC4=C(C=C(C=C4)C)C(=N3)C

InChI

InChI=1S/C24H28N2OS/c1-14-8-10-22-19(12-14)17(4)25-21-13-18(9-11-23(21)28-22)24(27)26-20-7-5-6-15(2)16(20)3/h8-13,15-16,20H,5-7H2,1-4H3,(H,26,27)