N-(azepan-1-yl)-6-piperidin-1-yl-pyrido[2,3-b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: N-(azepan-1-yl)-6-piperidin-1-yl-pyrido[2,3-b][1,4]benzothiazepine-3-carboxamide Openeye Name: N-(azepan-1-yl)-6-(1-piperidyl)pyrido[2,3-b][1,4]benzothiazepine-3-carboxamide CAS Name: N-(1-azepanyl)-6-(1-piperidinyl)-3-pyrido[2,3-b][1,4]benzothiazepinecarboxamide IUPAC Name: N-(azepan-1-yl)-6-piperidin-1-ylpyrido[2,3-b][1,4]benzothiazepine-3-carboxamide Traditional Name: N-(azepan-1-yl)-6-piperidino-pyrido[2,3-b][1,4]benzothiazepine-3-carboxamide Formula: C24H29N5OS MolecularWeight: 435.58496

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)NC(=O)C2=CC3=C(N=C2)SC4=CC=CC=C4C(=N3)N5CCCCC5

Isomeric SMILES

C1CCCN(CC1)NC(=O)C2=CC3=C(N=C2)SC4=CC=CC=C4C(=N3)N5CCCCC5

InChI

InChI=1S/C24H29N5OS/c30-23(27-29-14-8-1-2-9-15-29)18-16-20-24(25-17-18)31-21-11-5-4-10-19(21)22(26-20)28-12-6-3-7-13-28/h4-5,10-11,16-17H,1-3,6-9,12-15H2,(H,27,30)