4-[[1-(2,4-dichlorophenyl)-3-methyl-5-oxidanylidene-1,2,4-triazol-4-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[1-(2,4-dichlorophenyl)-3-methyl-5-oxidanylidene-1,2,4-triazol-4-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[1-(2,4-dichlorophenyl)-3-methyl-5-oxo-1,2,4-triazol-4-yl]methyl]benzonitrile CAS Name: 4-[[1-(2,4-dichlorophenyl)-3-methyl-5-oxo-1,2,4-triazol-4-yl]methyl]benzonitrile IUPAC Name: 4-[[1-(2,4-dichlorophenyl)-3-methyl-5-oxo-1,2,4-triazol-4-yl]methyl]benzonitrile Traditional Name: 4-[[1-(2,4-dichlorophenyl)-5-keto-3-methyl-1,2,4-triazol-4-yl]methyl]benzonitrile Formula: C17H12Cl2N4O MolecularWeight: 359.20938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)N1CC2=CC=C(C=C2)C#N)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=NN(C(=O)N1CC2=CC=C(C=C2)C#N)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H12Cl2N4O/c1-11-21-23(16-7-6-14(18)8-15(16)19)17(24)22(11)10-13-4-2-12(9-20)3-5-13/h2-8H,10H2,1H3