1-[[1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl]methyl]-3-(2-phenylphenyl)urea

Systemtic Name: 1-[[1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl]methyl]-3-(2-phenylphenyl)urea Openeye Name: 1-[[1-[(2,5-dimethylphenyl)methyl]-4-piperidyl]methyl]-3-(2-phenylphenyl)urea CAS Name: 1-[[1-[(2,5-dimethylphenyl)methyl]-4-piperidinyl]methyl]-3-(2-phenylphenyl)urea IUPAC Name: 1-[[1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl]methyl]-3-(2-phenylphenyl)urea Traditional Name: 1-[[1-(2,5-dimethylbenzyl)-4-piperidyl]methyl]-3-(2-phenylphenyl)urea Formula: C28H33N3O MolecularWeight: 427.58112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2CCC(CC2)CNC(=O)NC3=CC=CC=C3C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2CCC(CC2)CNC(=O)NC3=CC=CC=C3C4=CC=CC=C4

InChI

InChI=1S/C28H33N3O/c1-21-12-13-22(2)25(18-21)20-31-16-14-23(15-17-31)19-29-28(32)30-27-11-7-6-10-26(27)24-8-4-3-5-9-24/h3-13,18,23H,14-17,19-20H2,1-2H3,(H2,29,30,32)