1-(3-cyanophenyl)-3-[4-oxidanyl-2-[[4-(phenylmethyl)piperidin-1-yl]methyl]phenyl]urea

Systemtic Name: 1-(3-cyanophenyl)-3-[4-oxidanyl-2-[[4-(phenylmethyl)piperidin-1-yl]methyl]phenyl]urea Openeye Name: 1-[2-[(4-benzyl-1-piperidyl)methyl]-4-hydroxy-phenyl]-3-(3-cyanophenyl)urea CAS Name: 1-(3-cyanophenyl)-3-[4-hydroxy-2-[[4-(phenylmethyl)-1-piperidinyl]methyl]phenyl]urea IUPAC Name: 1-[2-[(4-benzylpiperidin-1-yl)methyl]-4-hydroxyphenyl]-3-(3-cyanophenyl)urea Traditional Name: 1-[2-[(4-benzylpiperidino)methyl]-4-hydroxy-phenyl]-3-(3-cyanophenyl)urea Formula: C27H28N4O2 MolecularWeight: 440.53682

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CC3=C(C=CC(=C3)O)NC(=O)NC4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CC3=C(C=CC(=C3)O)NC(=O)NC4=CC=CC(=C4)C#N

InChI

InChI=1S/C27H28N4O2/c28-18-22-7-4-8-24(16-22)29-27(33)30-26-10-9-25(32)17-23(26)19-31-13-11-21(12-14-31)15-20-5-2-1-3-6-20/h1-10,16-17,21,32H,11-15,19H2,(H2,29,30,33)