N-[1-(4-naphthalen-1-ylpiperazin-1-yl)ethyl]dibenzothiophene-1-carboxamide hydrochloride

Systemtic Name: N-[1-(4-naphthalen-1-ylpiperazin-1-yl)ethyl]dibenzothiophene-1-carboxamide hydrochloride Openeye Name: N-[1-[4-(1-naphthyl)piperazin-1-yl]ethyl]dibenzothiophene-1-carboxamide hydrochloride CAS Name: N-[1-[4-(1-naphthalenyl)-1-piperazinyl]ethyl]-1-dibenzothiophenecarboxamide hydrochloride IUPAC Name: N-[1-(4-naphthalen-1-ylpiperazin-1-yl)ethyl]dibenzothiophene-1-carboxamide hydrochloride Traditional Name: N-[1-[4-(1-naphthyl)piperazino]ethyl]dibenzothiophene-1-carboxamide hydrochloride Formula: C29H28ClN3OS MolecularWeight: 502.07012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(NC(=O)C1=C2C3=CC=CC=C3SC2=CC=C1)N4CCN(CC4)C5=CC=CC6=CC=CC=C65.Cl

Isomeric SMILES

CC(NC(=O)C1=C2C3=CC=CC=C3SC2=CC=C1)N4CCN(CC4)C5=CC=CC6=CC=CC=C65.Cl

InChI

InChI=1S/C29H27N3OS.ClH/c1-20(30-29(33)24-12-7-15-27-28(24)23-11-4-5-14-26(23)34-27)31-16-18-32(19-17-31)25-13-6-9-21-8-2-3-10-22(21)25;/h2-15,20H,16-19H2,1H3,(H,30,33);1H