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

Systemtic Name: 12-(5-pyrrolidin-1-ylpentyl)-6,7-dihydro-[1]benzothiepino[5,4-b]indole Openeye Name: 12-(5-pyrrolidin-1-ylpentyl)-6,7-dihydro-[1]benzothiepino[5,4-b]indole CAS Name: 12-[5-(1-pyrrolidinyl)pentyl]-6,7-dihydro-[1]benzothiepino[5,4-b]indole IUPAC Name: 12-(5-pyrrolidin-1-ylpentyl)-6,7-dihydro-[1]benzothiepino[5,4-b]indole Traditional Name: 12-(5-pyrrolidinopentyl)-6,7-dihydro-[1]benzothiepin[5,4-b]indole Formula: C25H30N2S MolecularWeight: 390.5841

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCCCN2C3=CC=CC=C3C4=C2C5=CC=CC=C5SCC4

Isomeric SMILES

C1CCN(C1)CCCCCN2C3=CC=CC=C3C4=C2C5=CC=CC=C5SCC4

InChI

InChI=1S/C25H30N2S/c1(6-15-26-16-8-9-17-26)7-18-27-23-12-4-2-10-20(23)21-14-19-28-24-13-5-3-11-22(24)25(21)27/h2-5,10-13H,1,6-9,14-19H2