3-[[3,5-bis(oxidanylidene)-1,2-diphenyl-1,2,4-triazolidin-4-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-[[3,5-bis(oxidanylidene)-1,2-diphenyl-1,2,4-triazolidin-4-yl]methyl]benzenecarbonitrile Openeye Name: 3-[(3,5-dioxo-1,2-diphenyl-1,2,4-triazolidin-4-yl)methyl]benzonitrile CAS Name: 3-[(3,5-dioxo-1,2-diphenyl-1,2,4-triazolidin-4-yl)methyl]benzonitrile IUPAC Name: 3-[(3,5-dioxo-1,2-diphenyl-1,2,4-triazolidin-4-yl)methyl]benzonitrile Traditional Name: 3-[(3,5-diketo-1,2-diphenyl-1,2,4-triazolidin-4-yl)methyl]benzonitrile Formula: C22H16N4O2 MolecularWeight: 368.38804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)N(C(=O)N2C3=CC=CC=C3)CC4=CC=CC(=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)N(C(=O)N2C3=CC=CC=C3)CC4=CC=CC(=C4)C#N

InChI

InChI=1S/C22H16N4O2/c23-15-17-8-7-9-18(14-17)16-24-21(27)25(19-10-3-1-4-11-19)26(22(24)28)20-12-5-2-6-13-20/h1-14H,16H2