4-(4-methylphenyl)-6-(2-methylpropylamino)-2-methylsulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-(4-methylphenyl)-6-(2-methylpropylamino)-2-methylsulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4-(isobutylamino)-2-methylsulfanyl-6-(p-tolyl)pyrimidine-5-carbonitrile CAS Name: 4-(4-methylphenyl)-6-(2-methylpropylamino)-2-(methylthio)-5-pyrimidinecarbonitrile IUPAC Name: 4-(4-methylphenyl)-6-(2-methylpropylamino)-2-methylsulfanylpyrimidine-5-carbonitrile Traditional Name: 4-(isobutylamino)-2-(methylthio)-6-(p-tolyl)pyrimidine-5-carbonitrile Formula: C17H20N4S MolecularWeight: 312.4325

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=NC(=N2)SC)NCC(C)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=NC(=N2)SC)NCC(C)C)C#N

InChI

InChI=1S/C17H20N4S/c1-11(2)10-19-16-14(9-18)15(20-17(21-16)22-4)13-7-5-12(3)6-8-13/h5-8,11H,10H2,1-4H3,(H,19,20,21)