1-[[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperidin-4-yl]carbonylamino]-3-phenyl-urea

Systemtic Name: 1-[[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperidin-4-yl]carbonylamino]-3-phenyl-urea Openeye Name: 1-[[1-[(2-chloro-4-fluoro-phenyl)methyl]piperidine-4-carbonyl]amino]-3-phenyl-urea CAS Name: 1-[[[1-[(2-chloro-4-fluorophenyl)methyl]-4-piperidinyl]-oxomethyl]amino]-3-phenylurea IUPAC Name: 1-[[1-[(2-chloro-4-fluorophenyl)methyl]piperidine-4-carbonyl]amino]-3-phenylurea Traditional Name: 1-[[1-(2-chloro-4-fluoro-benzyl)isonipecotoyl]amino]-3-phenyl-urea Formula: C20H22ClFN4O2 MolecularWeight: 404.865683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NNC(=O)NC2=CC=CC=C2)CC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NNC(=O)NC2=CC=CC=C2)CC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C20H22ClFN4O2/c21-18-12-16(22)7-6-15(18)13-26-10-8-14(9-11-26)19(27)24-25-20(28)23-17-4-2-1-3-5-17/h1-7,12,14H,8-11,13H2,(H,24,27)(H2,23,25,28)