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

Systemtic Name: 2-[(3-chlorophenyl)methylsulfanyl]-6-methyl-5-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]-1H-pyrimidin-4-one Openeye Name: 2-[(3-chlorophenyl)methylsulfanyl]-6-methyl-5-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl]-1H-pyrimidin-4-one CAS Name: 2-[(3-chlorophenyl)methylthio]-6-methyl-5-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]-1H-pyrimidin-4-one IUPAC Name: 2-[(3-chlorophenyl)methylsulfanyl]-6-methyl-5-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1H-pyrimidin-4-one Traditional Name: 2-[(3-chlorobenzyl)thio]-5-[2-keto-2-(4-methylpiperidino)ethyl]-6-methyl-1H-pyrimidin-4-one Formula: C20H24ClN3O2S MolecularWeight: 405.94146

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CC2=C(NC(=NC2=O)SCC3=CC(=CC=C3)Cl)C

Isomeric SMILES

CC1CCN(CC1)C(=O)CC2=C(NC(=NC2=O)SCC3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C20H24ClN3O2S/c1-13-6-8-24(9-7-13)18(25)11-17-14(2)22-20(23-19(17)26)27-12-15-4-3-5-16(21)10-15/h3-5,10,13H,6-9,11-12H2,1-2H3,(H,22,23,26)