1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-[(1-pyridin-4-ylcarbonylpiperidin-4-yl)methyl]phenyl]urea

Systemtic Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-[(1-pyridin-4-ylcarbonylpiperidin-4-yl)methyl]phenyl]urea Openeye Name: 1-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-3-[4-[[1-(pyridine-4-carbonyl)-4-piperidyl]methyl]phenyl]urea CAS Name: 1-[5-tert-butyl-2-(4-methylphenyl)-3-pyrazolyl]-3-[4-[[1-[oxo(pyridin-4-yl)methyl]-4-piperidinyl]methyl]phenyl]urea IUPAC Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-[[1-(pyridine-4-carbonyl)piperidin-4-yl]methyl]phenyl]urea Traditional Name: 1-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-3-[4-[(1-isonicotinoyl-4-piperidyl)methyl]phenyl]urea Formula: C33H38N6O2 MolecularWeight: 550.69382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C=C3)CC4CCN(CC4)C(=O)C5=CC=NC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C=C3)CC4CCN(CC4)C(=O)C5=CC=NC=C5

InChI

InChI=1S/C33H38N6O2/c1-23-5-11-28(12-6-23)39-30(22-29(37-39)33(2,3)4)36-32(41)35-27-9-7-24(8-10-27)21-25-15-19-38(20-16-25)31(40)26-13-17-34-18-14-26/h5-14,17-18,22,25H,15-16,19-21H2,1-4H3,(H2,35,36,41)