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

Systemtic Name: 4-(4-chlorophenyl)-6-[methyl-(phenylmethyl)amino]-2-methylsulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4-[benzyl(methyl)amino]-6-(4-chlorophenyl)-2-methylsulfanyl-pyrimidine-5-carbonitrile CAS Name: 4-(4-chlorophenyl)-6-[methyl-(phenylmethyl)amino]-2-(methylthio)-5-pyrimidinecarbonitrile IUPAC Name: 4-[benzyl(methyl)amino]-6-(4-chlorophenyl)-2-methylsulfanylpyrimidine-5-carbonitrile Traditional Name: 4-[benzyl(methyl)amino]-6-(4-chlorophenyl)-2-(methylthio)pyrimidine-5-carbonitrile Formula: C20H17ClN4S MolecularWeight: 380.89378

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2=NC(=NC(=C2C#N)C3=CC=C(C=C3)Cl)SC

Isomeric SMILES

CN(CC1=CC=CC=C1)C2=NC(=NC(=C2C#N)C3=CC=C(C=C3)Cl)SC

InChI

InChI=1S/C20H17ClN4S/c1-25(13-14-6-4-3-5-7-14)19-17(12-22)18(23-20(24-19)26-2)15-8-10-16(21)11-9-15/h3-11H,13H2,1-2H3