2-[2-[(4-methoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-(2-methoxyphenyl)-6-oxidanylidene-pyrimidin-4-olate

Systemtic Name: 2-[2-[(4-methoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-(2-methoxyphenyl)-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 2-[2-(4-methoxycarbonylanilino)-2-oxo-ethyl]sulfanyl-3-(2-methoxyphenyl)-6-oxo-pyrimidin-4-olate CAS Name: 2-[[2-(4-methoxycarbonylanilino)-2-oxoethyl]thio]-3-(2-methoxyphenyl)-6-oxo-4-pyrimidinolate IUPAC Name: 2-[2-(4-methoxycarbonylanilino)-2-oxoethyl]sulfanyl-3-(2-methoxyphenyl)-6-oxopyrimidin-4-olate Traditional Name: 2-[[2-(4-carbomethoxyanilino)-2-keto-ethyl]thio]-6-keto-3-(2-methoxyphenyl)pyrimidin-4-olate Formula: C21H18N3O6S- MolecularWeight: 440.44912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=CC(=O)N=C2SCC(=O)NC3=CC=C(C=C3)C(=O)OC)[O-]

Isomeric SMILES

COC1=CC=CC=C1N2C(=CC(=O)N=C2SCC(=O)NC3=CC=C(C=C3)C(=O)OC)[O-]

InChI

InChI=1S/C21H19N3O6S/c1-29-16-6-4-3-5-15(16)24-19(27)11-17(25)23-21(24)31-12-18(26)22-14-9-7-13(8-10-14)20(28)30-2/h3-11,27H,12H2,1-2H3,(H,22,26)/p-1