4-[4-(2-hydroxyethyl)piperazin-1-yl]-6-(4-methylphenyl)-2-methylsulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-[4-(2-hydroxyethyl)piperazin-1-yl]-6-(4-methylphenyl)-2-methylsulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4-[4-(2-hydroxyethyl)piperazin-1-yl]-2-methylsulfanyl-6-(p-tolyl)pyrimidine-5-carbonitrile CAS Name: 4-[4-(2-hydroxyethyl)-1-piperazinyl]-6-(4-methylphenyl)-2-(methylthio)-5-pyrimidinecarbonitrile IUPAC Name: 4-[4-(2-hydroxyethyl)piperazin-1-yl]-6-(4-methylphenyl)-2-methylsulfanylpyrimidine-5-carbonitrile Traditional Name: 4-[4-(2-hydroxyethyl)piperazino]-2-(methylthio)-6-(p-tolyl)pyrimidine-5-carbonitrile Formula: C19H23N5OS MolecularWeight: 369.48382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=NC(=N2)SC)N3CCN(CC3)CCO)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=NC(=N2)SC)N3CCN(CC3)CCO)C#N

InChI

InChI=1S/C19H23N5OS/c1-14-3-5-15(6-4-14)17-16(13-20)18(22-19(21-17)26-2)24-9-7-23(8-10-24)11-12-25/h3-6,25H,7-12H2,1-2H3