(5-ethoxycarbonyl-2-oxidanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidin-6-yl)methyl 2-(furan-2-yl)quinoline-4-carboxylate

Systemtic Name: (5-ethoxycarbonyl-2-oxidanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidin-6-yl)methyl 2-(furan-2-yl)quinoline-4-carboxylate Openeye Name: [5-ethoxycarbonyl-2-oxo-4-(2-thienyl)-3,4-dihydro-1H-pyrimidin-6-yl]methyl 2-(2-furyl)quinoline-4-carboxylate CAS Name: 2-(2-furanyl)-4-quinolinecarboxylic acid (5-ethoxycarbonyl-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidin-6-yl)methyl ester IUPAC Name: (5-ethoxycarbonyl-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidin-6-yl)methyl 2-(furan-2-yl)quinoline-4-carboxylate Traditional Name: 2-(2-furyl)cinchoninic acid [5-carbethoxy-2-keto-4-(2-thienyl)-3,4-dihydro-1H-pyrimidin-6-yl]methyl ester Formula: C26H21N3O6S MolecularWeight: 503.52644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CS2)COC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CO5

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CS2)COC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CO5

InChI

InChI=1S/C26H21N3O6S/c1-2-33-25(31)22-19(28-26(32)29-23(22)21-10-6-12-36-21)14-35-24(30)16-13-18(20-9-5-11-34-20)27-17-8-4-3-7-15(16)17/h3-13,23H,2,14H2,1H3,(H2,28,29,32)