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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC(=NC(=C2C#N)C)C3=CC=CC=C3Cl

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC(=NC(=C2C#N)C)C3=CC=CC=C3Cl

InChI

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