12-(6-piperidin-1-ylhexyl)-6,7-dihydro-[1]benzothiepino[5,4-b]indole

Systemtic Name: 12-(6-piperidin-1-ylhexyl)-6,7-dihydro-[1]benzothiepino[5,4-b]indole Openeye Name: 12-[6-(1-piperidyl)hexyl]-6,7-dihydro-[1]benzothiepino[5,4-b]indole CAS Name: 12-[6-(1-piperidinyl)hexyl]-6,7-dihydro-[1]benzothiepino[5,4-b]indole IUPAC Name: 12-(6-piperidin-1-ylhexyl)-6,7-dihydro-[1]benzothiepino[5,4-b]indole Traditional Name: 12-(6-piperidinohexyl)-6,7-dihydro-[1]benzothiepin[5,4-b]indole Formula: C27H34N2S MolecularWeight: 418.63726

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCCCCN2C3=CC=CC=C3C4=C2C5=CC=CC=C5SCC4

Isomeric SMILES

C1CCN(CC1)CCCCCCN2C3=CC=CC=C3C4=C2C5=CC=CC=C5SCC4

InChI

InChI=1S/C27H34N2S/c1(8-17-28-18-9-3-10-19-28)2-11-20-29-25-14-6-4-12-22(25)23-16-21-30-26-15-7-5-13-24(26)27(23)29/h4-7,12-15H,1-3,8-11,16-21H2