4,5-bis[(E)-(phenylmethylidene)amino]-1,2,4-triazol-3-amine

Systemtic Name: 4,5-bis[(E)-(phenylmethylidene)amino]-1,2,4-triazol-3-amine Openeye Name: 4,5-bis[(E)-benzylideneamino]-1,2,4-triazol-3-amine CAS Name: 4,5-bis[(E)-(phenylmethylene)amino]-1,2,4-triazol-3-amine IUPAC Name: 4,5-bis[(E)-benzylideneamino]-1,2,4-triazol-3-amine Traditional Name: [4,5-bis[(E)-benzalamino]-1,2,4-triazol-3-yl]amine Formula: C16H14N6 MolecularWeight: 290.32256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=NC2=NN=C(N2N=CC3=CC=CC=C3)N

Isomeric SMILES

C1=CC=C(C=C1)/C=N/C2=NN=C(N2/N=C/C3=CC=CC=C3)N

InChI

InChI=1S/C16H14N6/c17-15-20-21-16(18-11-13-7-3-1-4-8-13)22(15)19-12-14-9-5-2-6-10-14/h1-12H,(H2,17,20)/b18-11+,19-12+