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

Systemtic Name: 1-[[1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]urea Openeye Name: [[1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]urea CAS Name: [[1-(4-methylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]amino]urea IUPAC Name: [[1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]urea Traditional Name: [[1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]urea Formula: C13H13N7O MolecularWeight: 283.28862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NNC(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NNC(=O)N

InChI

InChI=1S/C13H13N7O/c1-8-2-4-9(5-3-8)20-12-10(6-17-20)11(15-7-16-12)18-19-13(14)21/h2-7H,1H3,(H3,14,19,21)(H,15,16,18)