1-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]-1-[(4-methylphenyl)methyl]-3-(phenylmethyl)urea

Systemtic Name: 1-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]-1-[(4-methylphenyl)methyl]-3-(phenylmethyl)urea Openeye Name: 3-benzyl-1-[1-(1H-imidazol-2-ylmethyl)-4-piperidyl]-1-(p-tolylmethyl)urea CAS Name: 1-[1-(1H-imidazol-2-ylmethyl)-4-piperidinyl]-1-[(4-methylphenyl)methyl]-3-(phenylmethyl)urea IUPAC Name: 3-benzyl-1-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]-1-[(4-methylphenyl)methyl]urea Traditional Name: 3-benzyl-1-[1-(1H-imidazol-2-ylmethyl)-4-piperidyl]-1-(4-methylbenzyl)urea Formula: C25H31N5O MolecularWeight: 417.54654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2CCN(CC2)CC3=NC=CN3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2CCN(CC2)CC3=NC=CN3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C25H31N5O/c1-20-7-9-22(10-8-20)18-30(25(31)28-17-21-5-3-2-4-6-21)23-11-15-29(16-12-23)19-24-26-13-14-27-24/h2-10,13-14,23H,11-12,15-19H2,1H3,(H,26,27)(H,28,31)