4-[(4-chlorophenyl)methylsulfanylmethyl]-6-(4-methylphenyl)sulfanyl-2-phenyl-pyrimidine

Systemtic Name: 4-[(4-chlorophenyl)methylsulfanylmethyl]-6-(4-methylphenyl)sulfanyl-2-phenyl-pyrimidine Openeye Name: 4-[(4-chlorophenyl)methylsulfanylmethyl]-2-phenyl-6-(p-tolylsulfanyl)pyrimidine CAS Name: 4-[[(4-chlorophenyl)methylthio]methyl]-6-[(4-methylphenyl)thio]-2-phenylpyrimidine IUPAC Name: 4-[(4-chlorophenyl)methylsulfanylmethyl]-6-(4-methylphenyl)sulfanyl-2-phenylpyrimidine Traditional Name: 4-[[(4-chlorobenzyl)thio]methyl]-2-phenyl-6-(p-tolylthio)pyrimidine Formula: C25H21ClN2S2 MolecularWeight: 449.03064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC(=NC(=C2)CSCC3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC(=NC(=C2)CSCC3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C25H21ClN2S2/c1-18-7-13-23(14-8-18)30-24-15-22(17-29-16-19-9-11-21(26)12-10-19)27-25(28-24)20-5-3-2-4-6-20/h2-15H,16-17H2,1H3