4-[2,1,3-benzoxadiazol-4-yl(pyrimidin-5-yl)amino]benzenecarbonitrile

Systemtic Name: 4-[2,1,3-benzoxadiazol-4-yl(pyrimidin-5-yl)amino]benzenecarbonitrile Openeye Name: 4-[2,1,3-benzoxadiazol-4-yl(pyrimidin-5-yl)amino]benzonitrile CAS Name: 4-[2,1,3-benzoxadiazol-4-yl(5-pyrimidinyl)amino]benzonitrile IUPAC Name: 4-[2,1,3-benzoxadiazol-4-yl(pyrimidin-5-yl)amino]benzonitrile Traditional Name: 4-[benzofurazan-4-yl(5-pyrimidyl)amino]benzonitrile Formula: C17H10N6O MolecularWeight: 314.3009

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NON=C2C(=C1)N(C3=CC=C(C=C3)C#N)C4=CN=CN=C4

Isomeric SMILES

C1=CC2=NON=C2C(=C1)N(C3=CC=C(C=C3)C#N)C4=CN=CN=C4

InChI

InChI=1S/C17H10N6O/c18-8-12-4-6-13(7-5-12)23(14-9-19-11-20-10-14)16-3-1-2-15-17(16)22-24-21-15/h1-7,9-11H