6-(1,5-diphenyl-1,2,4-triazol-3-yl)-2-oxidanylidene-4-phenyl-pyran-3-carbonitrile

Systemtic Name: 6-(1,5-diphenyl-1,2,4-triazol-3-yl)-2-oxidanylidene-4-phenyl-pyran-3-carbonitrile Openeye Name: 6-(1,5-diphenyl-1,2,4-triazol-3-yl)-2-oxo-4-phenyl-pyran-3-carbonitrile CAS Name: 6-(1,5-diphenyl-1,2,4-triazol-3-yl)-2-oxo-4-phenyl-3-pyrancarbonitrile IUPAC Name: 6-(1,5-diphenyl-1,2,4-triazol-3-yl)-2-oxo-4-phenylpyran-3-carbonitrile Traditional Name: 6-(1,5-diphenyl-1,2,4-triazol-3-yl)-2-keto-4-phenyl-pyran-3-carbonitrile Formula: C26H16N4O2 MolecularWeight: 416.43084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)OC(=C2)C3=NN(C(=N3)C4=CC=CC=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)OC(=C2)C3=NN(C(=N3)C4=CC=CC=C4)C5=CC=CC=C5)C#N

InChI

InChI=1S/C26H16N4O2/c27-17-22-21(18-10-4-1-5-11-18)16-23(32-26(22)31)24-28-25(19-12-6-2-7-13-19)30(29-24)20-14-8-3-9-15-20/h1-16H