5-ethanoyl-6-methyl-4-[1-oxidanylidene-1-[4-(phenylsulfonyl)piperazin-1-yl]propan-2-yl]sulfanyl-1H-pyrimidin-2-one

Systemtic Name: 5-ethanoyl-6-methyl-4-[1-oxidanylidene-1-[4-(phenylsulfonyl)piperazin-1-yl]propan-2-yl]sulfanyl-1H-pyrimidin-2-one Openeye Name: 5-acetyl-4-[2-[4-(benzenesulfonyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl]sulfanyl-6-methyl-1H-pyrimidin-2-one CAS Name: 5-acetyl-4-[[1-[4-(benzenesulfonyl)-1-piperazinyl]-1-oxopropan-2-yl]thio]-6-methyl-1H-pyrimidin-2-one IUPAC Name: 5-acetyl-4-[1-[4-(benzenesulfonyl)piperazin-1-yl]-1-oxopropan-2-yl]sulfanyl-6-methyl-1H-pyrimidin-2-one Traditional Name: 5-acetyl-4-[[2-(4-besylpiperazino)-2-keto-1-methyl-ethyl]thio]-6-methyl-1H-pyrimidin-2-one Formula: C20H24N4O5S2 MolecularWeight: 464.55836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)SC(C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C(=O)C

Isomeric SMILES

CC1=C(C(=NC(=O)N1)SC(C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C(=O)C

InChI

InChI=1S/C20H24N4O5S2/c1-13-17(14(2)25)18(22-20(27)21-13)30-15(3)19(26)23-9-11-24(12-10-23)31(28,29)16-7-5-4-6-8-16/h4-8,15H,9-12H2,1-3H3,(H,21,22,27)