N4-(1-naphthalen-1-ylpyrazolo[3,4-d]pyrimidin-6-yl)benzene-1,4-diamine

Systemtic Name: N4-(1-naphthalen-1-ylpyrazolo[3,4-d]pyrimidin-6-yl)benzene-1,4-diamine Openeye Name: N4-[1-(1-naphthyl)pyrazolo[3,4-d]pyrimidin-6-yl]benzene-1,4-diamine CAS Name: N4-[1-(1-naphthalenyl)-6-pyrazolo[3,4-d]pyrimidinyl]benzene-1,4-diamine IUPAC Name: 4-N-(1-naphthalen-1-ylpyrazolo[3,4-d]pyrimidin-6-yl)benzene-1,4-diamine Traditional Name: (4-aminophenyl)-[1-(1-naphthyl)pyrazolo[3,4-d]pyrimidin-6-yl]amine Formula: C21H16N6 MolecularWeight: 352.39194

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2N3C4=NC(=NC=C4C=N3)NC5=CC=C(C=C5)N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2N3C4=NC(=NC=C4C=N3)NC5=CC=C(C=C5)N

InChI

InChI=1S/C21H16N6/c22-16-8-10-17(11-9-16)25-21-23-12-15-13-24-27(20(15)26-21)19-7-3-5-14-4-1-2-6-18(14)19/h1-13H,22H2,(H,23,25,26)