1-methyl-1-[(2-piperidin-1-ylphenyl)methyl]-3-[(6-pyrazol-1-ylpyridin-3-yl)methyl]urea

Systemtic Name: 1-methyl-1-[(2-piperidin-1-ylphenyl)methyl]-3-[(6-pyrazol-1-ylpyridin-3-yl)methyl]urea Openeye Name: 1-methyl-1-[[2-(1-piperidyl)phenyl]methyl]-3-[(6-pyrazol-1-yl-3-pyridyl)methyl]urea CAS Name: 1-methyl-1-[[2-(1-piperidinyl)phenyl]methyl]-3-[[6-(1-pyrazolyl)-3-pyridinyl]methyl]urea IUPAC Name: 1-methyl-1-[(2-piperidin-1-ylphenyl)methyl]-3-[(6-pyrazol-1-ylpyridin-3-yl)methyl]urea Traditional Name: 1-methyl-1-(2-piperidinobenzyl)-3-[(6-pyrazol-1-yl-3-pyridyl)methyl]urea Formula: C23H28N6O MolecularWeight: 404.50802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1N2CCCCC2)C(=O)NCC3=CN=C(C=C3)N4C=CC=N4

Isomeric SMILES

CN(CC1=CC=CC=C1N2CCCCC2)C(=O)NCC3=CN=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C23H28N6O/c1-27(18-20-8-3-4-9-21(20)28-13-5-2-6-14-28)23(30)25-17-19-10-11-22(24-16-19)29-15-7-12-26-29/h3-4,7-12,15-16H,2,5-6,13-14,17-18H2,1H3,(H,25,30)