2-[2-[(4-chlorophenyl)methylsulfanyl]-6-methyl-pyrimidin-4-yl]sulfanyl-1-(4-methoxyphenyl)ethanone

Systemtic Name: 2-[2-[(4-chlorophenyl)methylsulfanyl]-6-methyl-pyrimidin-4-yl]sulfanyl-1-(4-methoxyphenyl)ethanone Openeye Name: 2-[2-[(4-chlorophenyl)methylsulfanyl]-6-methyl-pyrimidin-4-yl]sulfanyl-1-(4-methoxyphenyl)ethanone CAS Name: 2-[[2-[(4-chlorophenyl)methylthio]-6-methyl-4-pyrimidinyl]thio]-1-(4-methoxyphenyl)ethanone IUPAC Name: 2-[2-[(4-chlorophenyl)methylsulfanyl]-6-methylpyrimidin-4-yl]sulfanyl-1-(4-methoxyphenyl)ethanone Traditional Name: 2-[[2-[(4-chlorobenzyl)thio]-6-methyl-pyrimidin-4-yl]thio]-1-(4-methoxyphenyl)ethanone Formula: C21H19ClN2O2S2 MolecularWeight: 430.97076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)Cl)SCC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)Cl)SCC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H19ClN2O2S2/c1-14-11-20(27-13-19(25)16-5-9-18(26-2)10-6-16)24-21(23-14)28-12-15-3-7-17(22)8-4-15/h3-11H,12-13H2,1-2H3