2-[2-[3,5-bis(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]sulfanyl-N-cyclopropyl-quinoline-4-carboxamide

Systemtic Name: 2-[2-[3,5-bis(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]sulfanyl-N-cyclopropyl-quinoline-4-carboxamide Openeye Name: 2-[2-[3,5-bis(2-furyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethyl]sulfanyl-N-cyclopropyl-quinoline-4-carboxamide CAS Name: 2-[[2-[3,5-bis(2-furanyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl]thio]-N-cyclopropyl-4-quinolinecarboxamide IUPAC Name: 2-[2-[3,5-bis(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-N-cyclopropylquinoline-4-carboxamide Traditional Name: 2-[[2-[3,5-bis(2-furyl)-2-pyrazolin-1-yl]-2-keto-ethyl]thio]-N-cyclopropyl-cinchoninamide Formula: C26H22N4O4S MolecularWeight: 486.54228

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)N4C(CC(=N4)C5=CC=CO5)C6=CC=CO6

Isomeric SMILES

C1CC1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)N4C(CC(=N4)C5=CC=CO5)C6=CC=CO6

InChI

InChI=1S/C26H22N4O4S/c31-25(30-21(23-8-4-12-34-23)14-20(29-30)22-7-3-11-33-22)15-35-24-13-18(26(32)27-16-9-10-16)17-5-1-2-6-19(17)28-24/h1-8,11-13,16,21H,9-10,14-15H2,(H,27,32)