1-[4-(3-azanyl-1-methyl-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-3-(3-methylphenyl)urea

Systemtic Name: 1-[4-(3-azanyl-1-methyl-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-3-(3-methylphenyl)urea Openeye Name: 1-[4-(3-amino-1-methyl-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-3-(m-tolyl)urea CAS Name: 1-[4-(3-amino-1-methyl-4-pyrazolo[3,4-b]pyridinyl)phenyl]-3-(3-methylphenyl)urea IUPAC Name: 1-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-3-(3-methylphenyl)urea Traditional Name: 1-[4-(3-amino-1-methyl-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-3-(m-tolyl)urea Formula: C21H20N6O MolecularWeight: 372.4231

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)C3=C4C(=NN(C4=NC=C3)C)N

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)C3=C4C(=NN(C4=NC=C3)C)N

InChI

InChI=1S/C21H20N6O/c1-13-4-3-5-16(12-13)25-21(28)24-15-8-6-14(7-9-15)17-10-11-23-20-18(17)19(22)26-27(20)2/h3-12H,1-2H3,(H2,22,26)(H2,24,25,28)