1-butyl-3-[4-[4-(phenylmethyl)piperidin-1-yl]-3-pyrrolidin-1-ylcarbonyl-phenyl]urea

Systemtic Name: 1-butyl-3-[4-[4-(phenylmethyl)piperidin-1-yl]-3-pyrrolidin-1-ylcarbonyl-phenyl]urea Openeye Name: 1-[4-(4-benzyl-1-piperidyl)-3-(pyrrolidine-1-carbonyl)phenyl]-3-butyl-urea CAS Name: 1-butyl-3-[3-[oxo(1-pyrrolidinyl)methyl]-4-[4-(phenylmethyl)-1-piperidinyl]phenyl]urea IUPAC Name: 1-[4-(4-benzylpiperidin-1-yl)-3-(pyrrolidine-1-carbonyl)phenyl]-3-butylurea Traditional Name: 1-[4-(4-benzylpiperidino)-3-(pyrrolidine-1-carbonyl)phenyl]-3-butyl-urea Formula: C28H38N4O2 MolecularWeight: 462.62692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=CC(=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3)C(=O)N4CCCC4

Isomeric SMILES

CCCCNC(=O)NC1=CC(=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3)C(=O)N4CCCC4

InChI

InChI=1S/C28H38N4O2/c1-2-3-15-29-28(34)30-24-11-12-26(25(21-24)27(33)32-16-7-8-17-32)31-18-13-23(14-19-31)20-22-9-5-4-6-10-22/h4-6,9-12,21,23H,2-3,7-8,13-20H2,1H3,(H2,29,30,34)