2-[[6-[(2-chlorophenyl)methyl]-5-oxidanylidene-2H-1,2,4-triazin-3-yl]amino]benzenecarbonitrile

Systemtic Name: 2-[[6-[(2-chlorophenyl)methyl]-5-oxidanylidene-2H-1,2,4-triazin-3-yl]amino]benzenecarbonitrile Openeye Name: 2-[[6-[(2-chlorophenyl)methyl]-5-oxo-2H-1,2,4-triazin-3-yl]amino]benzonitrile CAS Name: 2-[[6-[(2-chlorophenyl)methyl]-5-oxo-2H-1,2,4-triazin-3-yl]amino]benzonitrile IUPAC Name: 2-[[6-[(2-chlorophenyl)methyl]-5-oxo-2H-1,2,4-triazin-3-yl]amino]benzonitrile Traditional Name: 2-[[6-(2-chlorobenzyl)-5-keto-2H-1,2,4-triazin-3-yl]amino]benzonitrile Formula: C17H12ClN5O MolecularWeight: 337.76308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC2=NNC(=NC2=O)NC3=CC=CC=C3C#N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CC2=NNC(=NC2=O)NC3=CC=CC=C3C#N)Cl

InChI

InChI=1S/C17H12ClN5O/c18-13-7-3-1-5-11(13)9-15-16(24)21-17(23-22-15)20-14-8-4-2-6-12(14)10-19/h1-8H,9H2,(H2,20,21,23,24)