1-(6-propylbenzo[b][1,4]benzothiazepin-3-yl)carbonylpiperidine-4-carboxamide

Systemtic Name: 1-(6-propylbenzo[b][1,4]benzothiazepin-3-yl)carbonylpiperidine-4-carboxamide Openeye Name: 1-(6-propylbenzo[b][1,4]benzothiazepine-3-carbonyl)piperidine-4-carboxamide CAS Name: 1-[oxo-(6-propyl-3-benzo[b][1,4]benzothiazepinyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(6-propylbenzo[b][1,4]benzothiazepine-3-carbonyl)piperidine-4-carboxamide Traditional Name: 1-(6-propylbenzo[b][1,4]benzothiazepine-3-carbonyl)isonipecotamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=CC(=C2)C(=O)N3CCC(CC3)C(=O)N)SC4=CC=CC=C41

Isomeric SMILES

CCCC1=NC2=C(C=CC(=C2)C(=O)N3CCC(CC3)C(=O)N)SC4=CC=CC=C41

InChI

InChI=1S/C23H25N3O2S/c1-2-5-18-17-6-3-4-7-20(17)29-21-9-8-16(14-19(21)25-18)23(28)26-12-10-15(11-13-26)22(24)27/h3-4,6-9,14-15H,2,5,10-13H2,1H3,(H2,24,27)