(2S)-2-(4-ethoxyphenyl)-3-(furan-2-ylcarbonyl)-5-oxidanylidene-1-pyrimidin-2-yl-2H-pyrrol-4-olate

Systemtic Name: (2S)-2-(4-ethoxyphenyl)-3-(furan-2-ylcarbonyl)-5-oxidanylidene-1-pyrimidin-2-yl-2H-pyrrol-4-olate Openeye Name: (2S)-2-(4-ethoxyphenyl)-3-(furan-2-carbonyl)-5-oxo-1-pyrimidin-2-yl-2H-pyrrol-4-olate CAS Name: (2S)-2-(4-ethoxyphenyl)-3-[2-furanyl(oxo)methyl]-5-oxo-1-(2-pyrimidinyl)-2H-pyrrol-4-olate IUPAC Name: (2S)-2-(4-ethoxyphenyl)-3-(furan-2-carbonyl)-5-oxo-1-pyrimidin-2-yl-2H-pyrrol-4-olate Traditional Name: (5S)-4-(2-furoyl)-2-keto-5-p-phenetyl-1-(2-pyrimidyl)-3-pyrrolin-3-olate Formula: C21H16N3O5- MolecularWeight: 390.36884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2C(=C(C(=O)N2C3=NC=CC=N3)[O-])C(=O)C4=CC=CO4

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@H]2C(=C(C(=O)N2C3=NC=CC=N3)[O-])C(=O)C4=CC=CO4

InChI

InChI=1S/C21H17N3O5/c1-2-28-14-8-6-13(7-9-14)17-16(18(25)15-5-3-12-29-15)19(26)20(27)24(17)21-22-10-4-11-23-21/h3-12,17,26H,2H2,1H3/p-1/t17-/m0/s1