4-[4-[4,6-bis(azanyl)-1,3,5-triazin-2-yl]phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[4,6-bis(azanyl)-1,3,5-triazin-2-yl]phenyl]benzenecarbonitrile Openeye Name: 4-[4-(4,6-diamino-1,3,5-triazin-2-yl)phenyl]benzonitrile CAS Name: 4-[4-(4,6-diamino-1,3,5-triazin-2-yl)phenyl]benzonitrile IUPAC Name: 4-[4-(4,6-diamino-1,3,5-triazin-2-yl)phenyl]benzonitrile Traditional Name: 4-[4-(4,6-diamino-s-triazin-2-yl)phenyl]benzonitrile Formula: C16H12N6 MolecularWeight: 288.30668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C2=CC=C(C=C2)C3=NC(=NC(=N3)N)N

Isomeric SMILES

C1=CC(=CC=C1C#N)C2=CC=C(C=C2)C3=NC(=NC(=N3)N)N

InChI

InChI=1S/C16H12N6/c17-9-10-1-3-11(4-2-10)12-5-7-13(8-6-12)14-20-15(18)22-16(19)21-14/h1-8H,(H4,18,19,20,21,22)