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

Systemtic Name: 5-[3-[4-[2-(4-ethoxyphenyl)ethyl]piperidin-1-yl]-3-oxidanylidene-propyl]-6-methyl-2-methylsulfanyl-1H-pyrimidin-4-one Openeye Name: 5-[3-[4-[2-(4-ethoxyphenyl)ethyl]-1-piperidyl]-3-oxo-propyl]-6-methyl-2-methylsulfanyl-1H-pyrimidin-4-one CAS Name: 5-[3-[4-[2-(4-ethoxyphenyl)ethyl]-1-piperidinyl]-3-oxopropyl]-6-methyl-2-(methylthio)-1H-pyrimidin-4-one IUPAC Name: 5-[3-[4-[2-(4-ethoxyphenyl)ethyl]piperidin-1-yl]-3-oxopropyl]-6-methyl-2-methylsulfanyl-1H-pyrimidin-4-one Traditional Name: 5-[3-keto-3-[4-(2-p-phenetylethyl)piperidino]propyl]-6-methyl-2-(methylthio)-1H-pyrimidin-4-one Formula: C24H33N3O3S MolecularWeight: 443.60212

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)CCC3=C(NC(=NC3=O)SC)C

Isomeric SMILES

CCOC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)CCC3=C(NC(=NC3=O)SC)C

InChI

InChI=1S/C24H33N3O3S/c1-4-30-20-9-7-18(8-10-20)5-6-19-13-15-27(16-14-19)22(28)12-11-21-17(2)25-24(31-3)26-23(21)29/h7-10,19H,4-6,11-16H2,1-3H3,(H,25,26,29)