3-(3-bromophenyl)-1-[(6-methylpyridin-2-yl)methyl]-1-[1-(phenylmethyl)piperidin-4-yl]urea

Systemtic Name: 3-(3-bromophenyl)-1-[(6-methylpyridin-2-yl)methyl]-1-[1-(phenylmethyl)piperidin-4-yl]urea Openeye Name: 1-(1-benzyl-4-piperidyl)-3-(3-bromophenyl)-1-[(6-methyl-2-pyridyl)methyl]urea CAS Name: 3-(3-bromophenyl)-1-[(6-methyl-2-pyridinyl)methyl]-1-[1-(phenylmethyl)-4-piperidinyl]urea IUPAC Name: 1-(1-benzylpiperidin-4-yl)-3-(3-bromophenyl)-1-[(6-methylpyridin-2-yl)methyl]urea Traditional Name: 1-(1-benzyl-4-piperidyl)-3-(3-bromophenyl)-1-[(6-methyl-2-pyridyl)methyl]urea Formula: C26H29BrN4O MolecularWeight: 493.43866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CN(C2CCN(CC2)CC3=CC=CC=C3)C(=O)NC4=CC(=CC=C4)Br

Isomeric SMILES

CC1=NC(=CC=C1)CN(C2CCN(CC2)CC3=CC=CC=C3)C(=O)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C26H29BrN4O/c1-20-7-5-12-24(28-20)19-31(26(32)29-23-11-6-10-22(27)17-23)25-13-15-30(16-14-25)18-21-8-3-2-4-9-21/h2-12,17,25H,13-16,18-19H2,1H3,(H,29,32)