2-(4-chlorophenyl)-4-methyl-6-(pyridin-2-ylmethylsulfanyl)pyrimidine-5-carbonitrile

Systemtic Name: 2-(4-chlorophenyl)-4-methyl-6-(pyridin-2-ylmethylsulfanyl)pyrimidine-5-carbonitrile Openeye Name: 2-(4-chlorophenyl)-4-methyl-6-(2-pyridylmethylsulfanyl)pyrimidine-5-carbonitrile CAS Name: 2-(4-chlorophenyl)-4-methyl-6-(2-pyridinylmethylthio)-5-pyrimidinecarbonitrile IUPAC Name: 2-(4-chlorophenyl)-4-methyl-6-(pyridin-2-ylmethylsulfanyl)pyrimidine-5-carbonitrile Traditional Name: 2-(4-chlorophenyl)-4-methyl-6-(2-pyridylmethylthio)pyrimidine-5-carbonitrile Formula: C18H13ClN4S MolecularWeight: 352.84062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=C(C=C2)Cl)SCC3=CC=CC=N3)C#N

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=C(C=C2)Cl)SCC3=CC=CC=N3)C#N

InChI

InChI=1S/C18H13ClN4S/c1-12-16(10-20)18(24-11-15-4-2-3-9-21-15)23-17(22-12)13-5-7-14(19)8-6-13/h2-9H,11H2,1H3