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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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