N4-[1-(phenylmethyl)pyrazolo[3,4-d]pyrimidin-4-yl]benzene-1,4-diamine

Systemtic Name: N4-[1-(phenylmethyl)pyrazolo[3,4-d]pyrimidin-4-yl]benzene-1,4-diamine Openeye Name: N4-(1-benzylpyrazolo[3,4-d]pyrimidin-4-yl)benzene-1,4-diamine CAS Name: N4-[1-(phenylmethyl)-4-pyrazolo[3,4-d]pyrimidinyl]benzene-1,4-diamine IUPAC Name: 4-N-(1-benzylpyrazolo[3,4-d]pyrimidin-4-yl)benzene-1,4-diamine Traditional Name: (4-aminophenyl)-(1-benzylpyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C18H16N6 MolecularWeight: 316.35984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=N2)C(=NC=N3)NC4=CC=C(C=C4)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=N2)C(=NC=N3)NC4=CC=C(C=C4)N

InChI

InChI=1S/C18H16N6/c19-14-6-8-15(9-7-14)23-17-16-10-22-24(18(16)21-12-20-17)11-13-4-2-1-3-5-13/h1-10,12H,11,19H2,(H,20,21,23)