1-[1-(phenylmethyl)piperidin-4-yl]-3-[4-(trifluoromethylsulfanyl)phenyl]urea

Systemtic Name: 1-[1-(phenylmethyl)piperidin-4-yl]-3-[4-(trifluoromethylsulfanyl)phenyl]urea Openeye Name: 1-(1-benzyl-4-piperidyl)-3-[4-(trifluoromethylsulfanyl)phenyl]urea CAS Name: 1-[1-(phenylmethyl)-4-piperidinyl]-3-[4-(trifluoromethylthio)phenyl]urea IUPAC Name: 1-(1-benzylpiperidin-4-yl)-3-[4-(trifluoromethylsulfanyl)phenyl]urea Traditional Name: 1-(1-benzyl-4-piperidyl)-3-[4-(trifluoromethylthio)phenyl]urea Formula: C20H22F3N3OS MolecularWeight: 409.46839

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)NC2=CC=C(C=C2)SC(F)(F)F)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1NC(=O)NC2=CC=C(C=C2)SC(F)(F)F)CC3=CC=CC=C3

InChI

InChI=1S/C20H22F3N3OS/c21-20(22,23)28-18-8-6-16(7-9-18)24-19(27)25-17-10-12-26(13-11-17)14-15-4-2-1-3-5-15/h1-9,17H,10-14H2,(H2,24,25,27)