[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl] 4-[2,5-bis(oxidanylidene)-3-pyrimidin-2-ylsulfanyl-pyrrolidin-1-yl]benzoate

Systemtic Name: [2-(3-methoxyphenyl)-2-oxidanylidene-ethyl] 4-[2,5-bis(oxidanylidene)-3-pyrimidin-2-ylsulfanyl-pyrrolidin-1-yl]benzoate Openeye Name: [2-(3-methoxyphenyl)-2-oxo-ethyl] 4-(2,5-dioxo-3-pyrimidin-2-ylsulfanyl-pyrrolidin-1-yl)benzoate CAS Name: 4-[2,5-dioxo-3-(2-pyrimidinylthio)-1-pyrrolidinyl]benzoic acid [2-(3-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-methoxyphenyl)-2-oxoethyl] 4-(2,5-dioxo-3-pyrimidin-2-ylsulfanylpyrrolidin-1-yl)benzoate Traditional Name: 4-[2,5-diketo-3-(2-pyrimidylthio)pyrrolidino]benzoic acid [2-keto-2-(3-methoxyphenyl)ethyl] ester Formula: C24H19N3O6S MolecularWeight: 477.48916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)COC(=O)C2=CC=C(C=C2)N3C(=O)CC(C3=O)SC4=NC=CC=N4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)COC(=O)C2=CC=C(C=C2)N3C(=O)CC(C3=O)SC4=NC=CC=N4

InChI

InChI=1S/C24H19N3O6S/c1-32-18-5-2-4-16(12-18)19(28)14-33-23(31)15-6-8-17(9-7-15)27-21(29)13-20(22(27)30)34-24-25-10-3-11-26-24/h2-12,20H,13-14H2,1H3