1,3-di(piperidin-1-yl)propan-2-yl N-[2-(naphthalen-1-ylmethylsulfanyl)phenyl]carbamate

Systemtic Name: 1,3-di(piperidin-1-yl)propan-2-yl N-[2-(naphthalen-1-ylmethylsulfanyl)phenyl]carbamate Openeye Name: [2-(1-piperidyl)-1-(1-piperidylmethyl)ethyl] N-[2-(1-naphthylmethylsulfanyl)phenyl]carbamate CAS Name: N-[2-(1-naphthalenylmethylthio)phenyl]carbamic acid 1,3-bis(1-piperidinyl)propan-2-yl ester IUPAC Name: 1,3-di(piperidin-1-yl)propan-2-yl N-[2-(naphthalen-1-ylmethylsulfanyl)phenyl]carbamate Traditional Name: N-[2-(1-naphthylmethylthio)phenyl]carbamic acid [2-piperidino-1-(piperidinomethyl)ethyl] ester Formula: C31H39N3O2S MolecularWeight: 517.72526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(CN2CCCCC2)OC(=O)NC3=CC=CC=C3SCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CCN(CC1)CC(CN2CCCCC2)OC(=O)NC3=CC=CC=C3SCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C31H39N3O2S/c35-31(36-27(22-33-18-7-1-8-19-33)23-34-20-9-2-10-21-34)32-29-16-5-6-17-30(29)37-24-26-14-11-13-25-12-3-4-15-28(25)26/h3-6,11-17,27H,1-2,7-10,18-24H2,(H,32,35)