1-(3-methylphenyl)-3-[2-[[4-(phenylmethyl)piperidin-1-yl]methyl]cyclohexyl]urea

Systemtic Name: 1-(3-methylphenyl)-3-[2-[[4-(phenylmethyl)piperidin-1-yl]methyl]cyclohexyl]urea Openeye Name: 1-[2-[(4-benzyl-1-piperidyl)methyl]cyclohexyl]-3-(m-tolyl)urea CAS Name: 1-(3-methylphenyl)-3-[2-[[4-(phenylmethyl)-1-piperidinyl]methyl]cyclohexyl]urea IUPAC Name: 1-[2-[(4-benzylpiperidin-1-yl)methyl]cyclohexyl]-3-(3-methylphenyl)urea Traditional Name: 1-[2-[(4-benzylpiperidino)methyl]cyclohexyl]-3-(m-tolyl)urea Formula: C27H37N3O MolecularWeight: 419.60218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2CCCCC2CN3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2CCCCC2CN3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H37N3O/c1-21-8-7-12-25(18-21)28-27(31)29-26-13-6-5-11-24(26)20-30-16-14-23(15-17-30)19-22-9-3-2-4-10-22/h2-4,7-10,12,18,23-24,26H,5-6,11,13-17,19-20H2,1H3,(H2,28,29,31)