3-[[1,3-bis(azanyl)pyrrolo[3,2-f]quinazolin-7-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-[[1,3-bis(azanyl)pyrrolo[3,2-f]quinazolin-7-yl]methyl]benzenecarbonitrile Openeye Name: 3-[(1,3-diaminopyrrolo[3,2-f]quinazolin-7-yl)methyl]benzonitrile CAS Name: 3-[(1,3-diamino-7-pyrrolo[3,2-f]quinazolinyl)methyl]benzonitrile IUPAC Name: 3-[(1,3-diaminopyrrolo[3,2-f]quinazolin-7-yl)methyl]benzonitrile Traditional Name: 3-[(1,3-diaminopyrrolo[3,2-f]quinazolin-7-yl)methyl]benzonitrile Formula: C18H14N6 MolecularWeight: 314.34396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CN2C=CC3=C2C=CC4=C3C(=NC(=N4)N)N)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CN2C=CC3=C2C=CC4=C3C(=NC(=N4)N)N)C#N

InChI

InChI=1S/C18H14N6/c19-9-11-2-1-3-12(8-11)10-24-7-6-13-15(24)5-4-14-16(13)17(20)23-18(21)22-14/h1-8H,10H2,(H4,20,21,22,23)