1-(2-methylphenyl)-3-[4-[(2-methyl-6-pyrazol-1-yl-pyrimidin-4-yl)amino]phenyl]urea

Systemtic Name: 1-(2-methylphenyl)-3-[4-[(2-methyl-6-pyrazol-1-yl-pyrimidin-4-yl)amino]phenyl]urea Openeye Name: 1-[4-[(2-methyl-6-pyrazol-1-yl-pyrimidin-4-yl)amino]phenyl]-3-(o-tolyl)urea CAS Name: 1-(2-methylphenyl)-3-[4-[[2-methyl-6-(1-pyrazolyl)-4-pyrimidinyl]amino]phenyl]urea IUPAC Name: 1-(2-methylphenyl)-3-[4-[(2-methyl-6-pyrazol-1-ylpyrimidin-4-yl)amino]phenyl]urea Traditional Name: 1-[4-[(2-methyl-6-pyrazol-1-yl-pyrimidin-4-yl)amino]phenyl]-3-(o-tolyl)urea Formula: C22H21N7O MolecularWeight: 399.44844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)NC3=NC(=NC(=C3)N4C=CC=N4)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)NC3=NC(=NC(=C3)N4C=CC=N4)C

InChI

InChI=1S/C22H21N7O/c1-15-6-3-4-7-19(15)28-22(30)27-18-10-8-17(9-11-18)26-20-14-21(25-16(2)24-20)29-13-5-12-23-29/h3-14H,1-2H3,(H,24,25,26)(H2,27,28,30)