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

Systemtic Name: 4-(2-dimethylaminoethylamino)-6-(4-methylphenyl)-2-methylsulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4-(2-dimethylaminoethylamino)-2-methylsulfanyl-6-(p-tolyl)pyrimidine-5-carbonitrile CAS Name: 4-(2-dimethylaminoethylamino)-6-(4-methylphenyl)-2-(methylthio)-5-pyrimidinecarbonitrile IUPAC Name: 4-(2-dimethylaminoethylamino)-6-(4-methylphenyl)-2-methylsulfanylpyrimidine-5-carbonitrile Traditional Name: 4-(2-dimethylaminoethylamino)-2-(methylthio)-6-(p-tolyl)pyrimidine-5-carbonitrile Formula: C17H21N5S MolecularWeight: 327.44714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N5S/c1-12-5-7-13(8-6-12)15-14(11-18)16(19-9-10-22(2)3)21-17(20-15)23-4/h5-8H,9-10H2,1-4H3,(H,19,20,21)