6-(4-methoxyphenyl)-2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-phenyl-1H-pyrimidin-3-ium-4-one

Systemtic Name: 6-(4-methoxyphenyl)-2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-phenyl-1H-pyrimidin-3-ium-4-one Openeye Name: 6-(4-methoxyphenyl)-2-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-3-phenyl-1H-pyrimidin-3-ium-4-one CAS Name: 6-(4-methoxyphenyl)-2-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-3-phenyl-1H-pyrimidin-3-ium-4-one IUPAC Name: 6-(4-methoxyphenyl)-2-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-3-phenyl-1H-pyrimidin-3-ium-4-one Traditional Name: 2-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-6-(4-methoxyphenyl)-3-phenyl-1H-pyrimidin-3-ium-4-one Formula: C26H23N2O4S+ MolecularWeight: 459.53682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=O)[N+](=C(N2)SCC(=O)C3=CC=C(C=C3)OC)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=O)[N+](=C(N2)SCC(=O)C3=CC=C(C=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C26H22N2O4S/c1-31-21-12-8-18(9-13-21)23-16-25(30)28(20-6-4-3-5-7-20)26(27-23)33-17-24(29)19-10-14-22(32-2)15-11-19/h3-16H,17H2,1-2H3/p+1