5-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-6-methyl-2-(phenylmethylsulfanyl)-1,3-diazinan-4-one

Systemtic Name: 5-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-6-methyl-2-(phenylmethylsulfanyl)-1,3-diazinan-4-one Openeye Name: 2-benzylsulfanyl-5-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-6-methyl-hexahydropyrimidin-4-one CAS Name: 5-[2-[(4-chlorophenyl)methylthio]ethyl]-6-methyl-2-(phenylmethylthio)-1,3-diazinan-4-one IUPAC Name: 2-benzylsulfanyl-5-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-6-methyl-1,3-diazinan-4-one Traditional Name: 2-(benzylthio)-5-[2-[(4-chlorobenzyl)thio]ethyl]-6-methyl-hexahydropyrimidin-4-one Formula: C21H25ClN2OS2 MolecularWeight: 421.019

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)NC(N1)SCC2=CC=CC=C2)CCSCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1C(C(=O)NC(N1)SCC2=CC=CC=C2)CCSCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H25ClN2OS2/c1-15-19(11-12-26-13-17-7-9-18(22)10-8-17)20(25)24-21(23-15)27-14-16-5-3-2-4-6-16/h2-10,15,19,21,23H,11-14H2,1H3,(H,24,25)