1-[4-(3-azanyl-2H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-3-(3-ethylphenyl)urea

Systemtic Name: 1-[4-(3-azanyl-2H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-3-(3-ethylphenyl)urea Openeye Name: 1-[4-(3-amino-2H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-3-(3-ethylphenyl)urea CAS Name: 1-[4-(3-amino-2H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-3-(3-ethylphenyl)urea IUPAC Name: 1-[4-(3-amino-2H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-3-(3-ethylphenyl)urea Traditional Name: 1-[4-(3-amino-2H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-3-(3-ethylphenyl)urea Formula: C21H20N6O MolecularWeight: 372.4231

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)C3=CC=NC4=NNC(=C34)N

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)C3=CC=NC4=NNC(=C34)N

InChI

InChI=1S/C21H20N6O/c1-2-13-4-3-5-16(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/h3-12H,2H2,1H3,(H2,24,25,28)(H3,22,23,26,27)