6-[3-(4-chloranylphenoxy)propylsulfanyl]-2H-1,2,4-triazine-3,5-dione

Systemtic Name: 6-[3-(4-chloranylphenoxy)propylsulfanyl]-2H-1,2,4-triazine-3,5-dione Openeye Name: 6-[3-(4-chlorophenoxy)propylsulfanyl]-2H-1,2,4-triazine-3,5-dione CAS Name: 6-[3-(4-chlorophenoxy)propylthio]-2H-1,2,4-triazine-3,5-dione IUPAC Name: 6-[3-(4-chlorophenoxy)propylsulfanyl]-2H-1,2,4-triazine-3,5-dione Traditional Name: 6-[3-(4-chlorophenoxy)propylthio]-2H-1,2,4-triazine-3,5-quinone Formula: C12H12ClN3O3S MolecularWeight: 313.75998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCCSC2=NNC(=O)NC2=O)Cl

Isomeric SMILES

C1=CC(=CC=C1OCCCSC2=NNC(=O)NC2=O)Cl

InChI

InChI=1S/C12H12ClN3O3S/c13-8-2-4-9(5-3-8)19-6-1-7-20-11-10(17)14-12(18)16-15-11/h2-5H,1,6-7H2,(H2,14,16,17,18)