1-[4-(4-azanylpyrazolo[3,4-d]pyrimidin-1-yl)phenyl]-3-propan-2-yl-urea

Systemtic Name: 1-[4-(4-azanylpyrazolo[3,4-d]pyrimidin-1-yl)phenyl]-3-propan-2-yl-urea Openeye Name: 1-[4-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)phenyl]-3-isopropyl-urea CAS Name: 1-[4-(4-amino-1-pyrazolo[3,4-d]pyrimidinyl)phenyl]-3-propan-2-ylurea IUPAC Name: 1-[4-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)phenyl]-3-propan-2-ylurea Traditional Name: 1-[4-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)phenyl]-3-isopropyl-urea Formula: C15H17N7O MolecularWeight: 311.34178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)N

Isomeric SMILES

CC(C)NC(=O)NC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)N

InChI

InChI=1S/C15H17N7O/c1-9(2)20-15(23)21-10-3-5-11(6-4-10)22-14-12(7-19-22)13(16)17-8-18-14/h3-9H,1-2H3,(H2,16,17,18)(H2,20,21,23)