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

Systemtic Name: 4-(4-chlorophenyl)-6-[(4-methylphenyl)amino]-2-methylsulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4-(4-chlorophenyl)-6-(4-methylanilino)-2-methylsulfanyl-pyrimidine-5-carbonitrile CAS Name: 4-(4-chlorophenyl)-6-(4-methylanilino)-2-(methylthio)-5-pyrimidinecarbonitrile IUPAC Name: 4-(4-chlorophenyl)-6-(4-methylanilino)-2-methylsulfanylpyrimidine-5-carbonitrile Traditional Name: 4-(4-chlorophenyl)-2-(methylthio)-6-(p-toluidino)pyrimidine-5-carbonitrile Formula: C19H15ClN4S MolecularWeight: 366.8672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC(=C2C#N)C3=CC=C(C=C3)Cl)SC

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=C2C#N)C3=CC=C(C=C3)Cl)SC

InChI

InChI=1S/C19H15ClN4S/c1-12-3-9-15(10-4-12)22-18-16(11-21)17(23-19(24-18)25-2)13-5-7-14(20)8-6-13/h3-10H,1-2H3,(H,22,23,24)