6-(2-aminophenyl)-3-[(4-chlorophenyl)methylsulfanyl]-2H-1,2,4-triazin-5-one

Systemtic Name: 6-(2-aminophenyl)-3-[(4-chlorophenyl)methylsulfanyl]-2H-1,2,4-triazin-5-one Openeye Name: 6-(2-aminophenyl)-3-[(4-chlorophenyl)methylsulfanyl]-2H-1,2,4-triazin-5-one CAS Name: 6-(2-aminophenyl)-3-[(4-chlorophenyl)methylthio]-2H-1,2,4-triazin-5-one IUPAC Name: 6-(2-aminophenyl)-3-[(4-chlorophenyl)methylsulfanyl]-2H-1,2,4-triazin-5-one Traditional Name: 6-(2-aminophenyl)-3-[(4-chlorobenzyl)thio]-2H-1,2,4-triazin-5-one Formula: C16H13ClN4OS MolecularWeight: 344.81862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NNC(=NC2=O)SCC3=CC=C(C=C3)Cl)N

Isomeric SMILES

C1=CC=C(C(=C1)C2=NNC(=NC2=O)SCC3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C16H13ClN4OS/c17-11-7-5-10(6-8-11)9-23-16-19-15(22)14(20-21-16)12-3-1-2-4-13(12)18/h1-8H,9,18H2,(H,19,21,22)