2-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[2-[2-[(4-chlorophenyl)thio]ethoxy]ethylthio]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[2-[2-[(4-chlorophenyl)thio]ethoxy]ethylthio]-6-methyl-1H-pyrimidin-4-one Formula: C15H17ClN2O2S2 MolecularWeight: 356.89068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCCOCCSC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCCOCCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H17ClN2O2S2/c1-11-10-14(19)18-15(17-11)22-9-7-20-6-8-21-13-4-2-12(16)3-5-13/h2-5,10H,6-9H2,1H3,(H,17,18,19)