2-[2-[(3S)-3,5-bis(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]sulfanyl-1-ethyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[2-[(3S)-3,5-bis(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]sulfanyl-1-ethyl-benzimidazole-5-sulfonamide Openeye Name: 2-[2-[(3S)-3,5-bis(2-furyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethyl]sulfanyl-1-ethyl-benzimidazole-5-sulfonamide CAS Name: 2-[[2-[(3S)-3,5-bis(2-furanyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl]thio]-1-ethyl-5-benzimidazolesulfonamide IUPAC Name: 2-[2-[(3S)-3,5-bis(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-1-ethylbenzimidazole-5-sulfonamide Traditional Name: 2-[[2-[(5S)-3,5-bis(2-furyl)-2-pyrazolin-1-yl]-2-keto-ethyl]thio]-1-ethyl-benzimidazole-5-sulfonamide Formula: C22H21N5O5S2 MolecularWeight: 499.56264

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)N3C(CC(=N3)C4=CC=CO4)C5=CC=CO5

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)N3[C@@H](CC(=N3)C4=CC=CO4)C5=CC=CO5

InChI

InChI=1S/C22H21N5O5S2/c1-2-26-17-8-7-14(34(23,29)30)11-15(17)24-22(26)33-13-21(28)27-18(20-6-4-10-32-20)12-16(25-27)19-5-3-9-31-19/h3-11,18H,2,12-13H2,1H3,(H2,23,29,30)/t18-/m0/s1