(2S)-3-(furan-2-ylcarbonyl)-1-(3-imidazol-1-ylpropyl)-5-oxidanylidene-2-pyridin-3-yl-2H-pyrrol-4-olate

Systemtic Name: (2S)-3-(furan-2-ylcarbonyl)-1-(3-imidazol-1-ylpropyl)-5-oxidanylidene-2-pyridin-3-yl-2H-pyrrol-4-olate Openeye Name: (2S)-3-(furan-2-carbonyl)-1-(3-imidazol-1-ylpropyl)-5-oxo-2-(3-pyridyl)-2H-pyrrol-4-olate CAS Name: (2S)-3-[2-furanyl(oxo)methyl]-1-[3-(1-imidazolyl)propyl]-5-oxo-2-(3-pyridinyl)-2H-pyrrol-4-olate IUPAC Name: (2S)-3-(furan-2-carbonyl)-1-(3-imidazol-1-ylpropyl)-5-oxo-2-pyridin-3-yl-2H-pyrrol-4-olate Traditional Name: (5S)-4-(2-furoyl)-1-(3-imidazol-1-ylpropyl)-2-keto-5-(3-pyridyl)-3-pyrrolin-3-olate Formula: C20H17N4O4- MolecularWeight: 377.37338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2C(=C(C(=O)N2CCCN3C=CN=C3)[O-])C(=O)C4=CC=CO4

Isomeric SMILES

C1=CC(=CN=C1)[C@H]2C(=C(C(=O)N2CCCN3C=CN=C3)[O-])C(=O)C4=CC=CO4

InChI

InChI=1S/C20H18N4O4/c25-18(15-5-2-11-28-15)16-17(14-4-1-6-21-12-14)24(20(27)19(16)26)9-3-8-23-10-7-22-13-23/h1-2,4-7,10-13,17,26H,3,8-9H2/p-1/t17-/m0/s1