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

Systemtic Name: 4-[4-(2-methoxyphenyl)piperazin-1-yl]-6-(4-methylphenyl)-2-methylsulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4-[4-(2-methoxyphenyl)piperazin-1-yl]-2-methylsulfanyl-6-(p-tolyl)pyrimidine-5-carbonitrile CAS Name: 4-[4-(2-methoxyphenyl)-1-piperazinyl]-6-(4-methylphenyl)-2-(methylthio)-5-pyrimidinecarbonitrile IUPAC Name: 4-[4-(2-methoxyphenyl)piperazin-1-yl]-6-(4-methylphenyl)-2-methylsulfanylpyrimidine-5-carbonitrile Traditional Name: 4-[4-(2-methoxyphenyl)piperazino]-2-(methylthio)-6-(p-tolyl)pyrimidine-5-carbonitrile Formula: C24H25N5OS MolecularWeight: 431.5532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=NC(=N2)SC)N3CCN(CC3)C4=CC=CC=C4OC)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=NC(=N2)SC)N3CCN(CC3)C4=CC=CC=C4OC)C#N

InChI

InChI=1S/C24H25N5OS/c1-17-8-10-18(11-9-17)22-19(16-25)23(27-24(26-22)31-3)29-14-12-28(13-15-29)20-6-4-5-7-21(20)30-2/h4-11H,12-15H2,1-3H3