1-(phenylmethyl)-N-[(E)-pyridin-3-ylmethylideneamino]pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1-(phenylmethyl)-N-[(E)-pyridin-3-ylmethylideneamino]pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-benzyl-N-[(E)-3-pyridylmethyleneamino]pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-(phenylmethyl)-N-[(E)-3-pyridinylmethylideneamino]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-benzyl-N-[(E)-pyridin-3-ylmethylideneamino]pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (1-benzylpyrazolo[3,4-d]pyrimidin-4-yl)-[(E)-3-pyridylmethyleneamino]amine Formula: C18H15N7 MolecularWeight: 329.3586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=N2)C(=NC=N3)NN=CC4=CN=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C18H15N7/c1-2-5-14(6-3-1)12-25-18-16(11-23-25)17(20-13-21-18)24-22-10-15-7-4-8-19-9-15/h1-11,13H,12H2,(H,20,21,24)/b22-10+