2-[[6-(2-aminophenyl)-5-oxidanylidene-2H-1,2,4-triazin-3-yl]sulfanyl]-N-(3-chloranyl-4-cyano-phenyl)ethanamide

Systemtic Name: 2-[[6-(2-aminophenyl)-5-oxidanylidene-2H-1,2,4-triazin-3-yl]sulfanyl]-N-(3-chloranyl-4-cyano-phenyl)ethanamide Openeye Name: 2-[[6-(2-aminophenyl)-5-oxo-2H-1,2,4-triazin-3-yl]sulfanyl]-N-(3-chloro-4-cyano-phenyl)acetamide CAS Name: 2-[[6-(2-aminophenyl)-5-oxo-2H-1,2,4-triazin-3-yl]thio]-N-(3-chloro-4-cyanophenyl)acetamide IUPAC Name: 2-[[6-(2-aminophenyl)-5-oxo-2H-1,2,4-triazin-3-yl]sulfanyl]-N-(3-chloro-4-cyanophenyl)acetamide Traditional Name: 2-[[6-(2-aminophenyl)-5-keto-2H-1,2,4-triazin-3-yl]thio]-N-(3-chloro-4-cyano-phenyl)acetamide Formula: C18H13ClN6O2S MolecularWeight: 412.85282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NNC(=NC2=O)SCC(=O)NC3=CC(=C(C=C3)C#N)Cl)N

Isomeric SMILES

C1=CC=C(C(=C1)C2=NNC(=NC2=O)SCC(=O)NC3=CC(=C(C=C3)C#N)Cl)N

InChI

InChI=1S/C18H13ClN6O2S/c19-13-7-11(6-5-10(13)8-20)22-15(26)9-28-18-23-17(27)16(24-25-18)12-3-1-2-4-14(12)21/h1-7H,9,21H2,(H,22,26)(H,23,25,27)