2-[(3-methoxyphenyl)methylsulfanyl]-6-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-1H-pyrimidin-4-one

Systemtic Name: 2-[(3-methoxyphenyl)methylsulfanyl]-6-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-1H-pyrimidin-4-one Openeye Name: 2-[(3-methoxyphenyl)methylsulfanyl]-6-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl]-1H-pyrimidin-4-one CAS Name: 2-[(3-methoxyphenyl)methylthio]-6-[2-(4-methylsulfonyl-1-piperazinyl)-2-oxoethyl]-1H-pyrimidin-4-one IUPAC Name: 2-[(3-methoxyphenyl)methylsulfanyl]-6-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxoethyl]-1H-pyrimidin-4-one Traditional Name: 6-[2-keto-2-(4-mesylpiperazino)ethyl]-2-(m-anisylthio)-1H-pyrimidin-4-one Formula: C19H24N4O5S2 MolecularWeight: 452.54766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CSC2=NC(=O)C=C(N2)CC(=O)N3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

COC1=CC=CC(=C1)CSC2=NC(=O)C=C(N2)CC(=O)N3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C19H24N4O5S2/c1-28-16-5-3-4-14(10-16)13-29-19-20-15(11-17(24)21-19)12-18(25)22-6-8-23(9-7-22)30(2,26)27/h3-5,10-11H,6-9,12-13H2,1-2H3,(H,20,21,24)