1-[(4-cyanophenyl)methyl]-3-(1-pyrimidin-2-ylpiperidin-3-yl)urea

Systemtic Name: 1-[(4-cyanophenyl)methyl]-3-(1-pyrimidin-2-ylpiperidin-3-yl)urea Openeye Name: 1-[(4-cyanophenyl)methyl]-3-(1-pyrimidin-2-yl-3-piperidyl)urea CAS Name: 1-[(4-cyanophenyl)methyl]-3-[1-(2-pyrimidinyl)-3-piperidinyl]urea IUPAC Name: 1-[(4-cyanophenyl)methyl]-3-(1-pyrimidin-2-ylpiperidin-3-yl)urea Traditional Name: 1-(4-cyanobenzyl)-3-[1-(2-pyrimidyl)-3-piperidyl]urea Formula: C18H20N6O MolecularWeight: 336.391

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=CC=N2)NC(=O)NCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1CC(CN(C1)C2=NC=CC=N2)NC(=O)NCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H20N6O/c19-11-14-4-6-15(7-5-14)12-22-18(25)23-16-3-1-10-24(13-16)17-20-8-2-9-21-17/h2,4-9,16H,1,3,10,12-13H2,(H2,22,23,25)