5-ethyl-6-[[3-[(5-ethyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl)methyl]phenyl]methyl]-2-piperidin-1-yl-1H-pyrimidin-4-one

Systemtic Name: 5-ethyl-6-[[3-[(5-ethyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl)methyl]phenyl]methyl]-2-piperidin-1-yl-1H-pyrimidin-4-one Openeye Name: 5-ethyl-6-[[3-[(5-ethyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-6-yl)methyl]phenyl]methyl]-2-(1-piperidyl)-1H-pyrimidin-4-one CAS Name: 5-ethyl-6-[[3-[[5-ethyl-2-(methylthio)-4-oxo-1H-pyrimidin-6-yl]methyl]phenyl]methyl]-2-(1-piperidinyl)-1H-pyrimidin-4-one IUPAC Name: 5-ethyl-6-[[3-[(5-ethyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-6-yl)methyl]phenyl]methyl]-2-piperidin-1-yl-1H-pyrimidin-4-one Traditional Name: 5-ethyl-6-[3-[[5-ethyl-4-keto-2-(methylthio)-1H-pyrimidin-6-yl]methyl]benzyl]-2-piperidino-1H-pyrimidin-4-one Formula: C26H33N5O2S MolecularWeight: 479.63752

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)N2CCCCC2)CC3=CC(=CC=C3)CC4=C(C(=O)N=C(N4)SC)CC

Isomeric SMILES

CCC1=C(NC(=NC1=O)N2CCCCC2)CC3=CC(=CC=C3)CC4=C(C(=O)N=C(N4)SC)CC

InChI

InChI=1S/C26H33N5O2S/c1-4-19-21(27-25(29-23(19)32)31-12-7-6-8-13-31)15-17-10-9-11-18(14-17)16-22-20(5-2)24(33)30-26(28-22)34-3/h9-11,14H,4-8,12-13,15-16H2,1-3H3,(H,27,29,32)(H,28,30,33)