2-(4-chlorophenyl)-4-methyl-6-[(2-methylphenyl)methylsulfanyl]pyrimidine-5-carbonitrile

Systemtic Name: 2-(4-chlorophenyl)-4-methyl-6-[(2-methylphenyl)methylsulfanyl]pyrimidine-5-carbonitrile Openeye Name: 2-(4-chlorophenyl)-4-methyl-6-(o-tolylmethylsulfanyl)pyrimidine-5-carbonitrile CAS Name: 2-(4-chlorophenyl)-4-methyl-6-[(2-methylphenyl)methylthio]-5-pyrimidinecarbonitrile IUPAC Name: 2-(4-chlorophenyl)-4-methyl-6-[(2-methylphenyl)methylsulfanyl]pyrimidine-5-carbonitrile Traditional Name: 2-(4-chlorophenyl)-4-methyl-6-[(2-methylbenzyl)thio]pyrimidine-5-carbonitrile Formula: C20H16ClN3S MolecularWeight: 365.87914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC(=NC(=C2C#N)C)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC(=NC(=C2C#N)C)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H16ClN3S/c1-13-5-3-4-6-16(13)12-25-20-18(11-22)14(2)23-19(24-20)15-7-9-17(21)10-8-15/h3-10H,12H2,1-2H3