4-(4-methylsulfanylphenyl)-2-(4-phenylpiperazin-1-yl)-6-pyridin-4-yl-pyrimidine

Systemtic Name: 4-(4-methylsulfanylphenyl)-2-(4-phenylpiperazin-1-yl)-6-pyridin-4-yl-pyrimidine Openeye Name: 4-(4-methylsulfanylphenyl)-2-(4-phenylpiperazin-1-yl)-6-(4-pyridyl)pyrimidine CAS Name: 4-[4-(methylthio)phenyl]-2-(4-phenyl-1-piperazinyl)-6-pyridin-4-ylpyrimidine IUPAC Name: 4-(4-methylsulfanylphenyl)-2-(4-phenylpiperazin-1-yl)-6-pyridin-4-ylpyrimidine Traditional Name: 4-[4-(methylthio)phenyl]-2-(4-phenylpiperazino)-6-(4-pyridyl)pyrimidine Formula: C26H25N5S MolecularWeight: 439.5752

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=CC(=NC(=N2)N3CCN(CC3)C4=CC=CC=C4)C5=CC=NC=C5

Isomeric SMILES

CSC1=CC=C(C=C1)C2=CC(=NC(=N2)N3CCN(CC3)C4=CC=CC=C4)C5=CC=NC=C5

InChI

InChI=1S/C26H25N5S/c1-32-23-9-7-20(8-10-23)24-19-25(21-11-13-27-14-12-21)29-26(28-24)31-17-15-30(16-18-31)22-5-3-2-4-6-22/h2-14,19H,15-18H2,1H3