2-[2-oxidanylidene-2-[3-(phenylsulfonyl)imidazolidin-1-yl]ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-oxidanylidene-2-[3-(phenylsulfonyl)imidazolidin-1-yl]ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[2-[3-(benzenesulfonyl)imidazolidin-1-yl]-2-oxo-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[2-[3-(benzenesulfonyl)-1-imidazolidinyl]-2-oxoethyl]thio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-[3-(benzenesulfonyl)imidazolidin-1-yl]-2-oxoethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-(3-besylimidazolidin-1-yl)-2-keto-ethyl]thio]-6-propyl-1H-pyrimidin-4-one Formula: C18H22N4O4S2 MolecularWeight: 422.52168

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)N2CCN(C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)N2CCN(C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H22N4O4S2/c1-2-6-14-11-16(23)20-18(19-14)27-12-17(24)21-9-10-22(13-21)28(25,26)15-7-4-3-5-8-15/h3-5,7-8,11H,2,6,9-10,12-13H2,1H3,(H,19,20,23)