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

Systemtic Name: 1-[1-(cyclohexylmethyl)piperidin-4-yl]-1-[(4-methylphenyl)methyl]-3-(phenylmethyl)urea Openeye Name: 3-benzyl-1-[1-(cyclohexylmethyl)-4-piperidyl]-1-(p-tolylmethyl)urea CAS Name: 1-[1-(cyclohexylmethyl)-4-piperidinyl]-1-[(4-methylphenyl)methyl]-3-(phenylmethyl)urea IUPAC Name: 3-benzyl-1-[1-(cyclohexylmethyl)piperidin-4-yl]-1-[(4-methylphenyl)methyl]urea Traditional Name: 3-benzyl-1-[1-(cyclohexylmethyl)-4-piperidyl]-1-(4-methylbenzyl)urea Formula: C28H39N3O MolecularWeight: 433.62876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2CCN(CC2)CC3CCCCC3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2CCN(CC2)CC3CCCCC3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C28H39N3O/c1-23-12-14-26(15-13-23)22-31(28(32)29-20-24-8-4-2-5-9-24)27-16-18-30(19-17-27)21-25-10-6-3-7-11-25/h2,4-5,8-9,12-15,25,27H,3,6-7,10-11,16-22H2,1H3,(H,29,32)