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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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