1-[1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-3-(4-methylphenyl)urea

Systemtic Name: 1-[1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-3-(4-methylphenyl)urea Openeye Name: 1-[1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-3-(p-tolyl)urea CAS Name: 1-[1-(2,4-dimethylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]-3-(4-methylphenyl)urea IUPAC Name: 1-[1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-3-(4-methylphenyl)urea Traditional Name: 1-[1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-3-(p-tolyl)urea Formula: C21H20N6O MolecularWeight: 372.4231

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NC2=NC=NC3=C2C=NN3C4=C(C=C(C=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NC2=NC=NC3=C2C=NN3C4=C(C=C(C=C4)C)C

InChI

InChI=1S/C21H20N6O/c1-13-4-7-16(8-5-13)25-21(28)26-19-17-11-24-27(20(17)23-12-22-19)18-9-6-14(2)10-15(18)3/h4-12H,1-3H3,(H2,22,23,25,26,28)