8-chloranyl-5-piperidin-4-yl-6H-benzo[b][1,4]benzothiazepine

Systemtic Name: 8-chloranyl-5-piperidin-4-yl-6H-benzo[b][1,4]benzothiazepine Openeye Name: 8-chloro-5-(4-piperidyl)-6H-benzo[b][1,4]benzothiazepine CAS Name: 8-chloro-5-(4-piperidinyl)-6H-benzo[b][1,4]benzothiazepine IUPAC Name: 8-chloro-5-piperidin-4-yl-6H-benzo[b][1,4]benzothiazepine Traditional Name: 8-chloro-5-(4-piperidyl)-6H-benzo[b][1,4]benzothiazepine Formula: C18H19ClN2S MolecularWeight: 330.87486

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1N2CC3=C(C=CC(=C3)Cl)SC4=CC=CC=C42

Isomeric SMILES

C1CNCCC1N2CC3=C(C=CC(=C3)Cl)SC4=CC=CC=C42

InChI

InChI=1S/C18H19ClN2S/c19-14-5-6-17-13(11-14)12-21(15-7-9-20-10-8-15)16-3-1-2-4-18(16)22-17/h1-6,11,15,20H,7-10,12H2