6-(4-methylphenyl)-1-(4-methylsulfanylphenyl)-3-[2-oxidanyl-3-(4-pyridin-2-ylpiperazin-1-yl)propyl]pyrimidine-2,4-dione

Systemtic Name: 6-(4-methylphenyl)-1-(4-methylsulfanylphenyl)-3-[2-oxidanyl-3-(4-pyridin-2-ylpiperazin-1-yl)propyl]pyrimidine-2,4-dione Openeye Name: 3-[2-hydroxy-3-[4-(2-pyridyl)piperazin-1-yl]propyl]-1-(4-methylsulfanylphenyl)-6-(p-tolyl)pyrimidine-2,4-dione CAS Name: 3-[2-hydroxy-3-[4-(2-pyridinyl)-1-piperazinyl]propyl]-6-(4-methylphenyl)-1-[4-(methylthio)phenyl]pyrimidine-2,4-dione IUPAC Name: 3-[2-hydroxy-3-(4-pyridin-2-ylpiperazin-1-yl)propyl]-6-(4-methylphenyl)-1-(4-methylsulfanylphenyl)pyrimidine-2,4-dione Traditional Name: 3-[2-hydroxy-3-[4-(2-pyridyl)piperazino]propyl]-1-[4-(methylthio)phenyl]-6-(p-tolyl)pyrimidine-2,4-quinone Formula: C30H33N5O3S MolecularWeight: 543.67972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=O)N(C(=O)N2C3=CC=C(C=C3)SC)CC(CN4CCN(CC4)C5=CC=CC=N5)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=O)N(C(=O)N2C3=CC=C(C=C3)SC)CC(CN4CCN(CC4)C5=CC=CC=N5)O

InChI

InChI=1S/C30H33N5O3S/c1-22-6-8-23(9-7-22)27-19-29(37)34(30(38)35(27)24-10-12-26(39-2)13-11-24)21-25(36)20-32-15-17-33(18-16-32)28-5-3-4-14-31-28/h3-14,19,25,36H,15-18,20-21H2,1-2H3