1-ethyl-2-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-sulfonamide

Systemtic Name: 1-ethyl-2-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-sulfonamide Openeye Name: 1-ethyl-2-[2-[(2S)-2-methylindolin-1-yl]-2-oxo-ethyl]sulfanyl-benzimidazole-5-sulfonamide CAS Name: 1-ethyl-2-[[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]thio]-5-benzimidazolesulfonamide IUPAC Name: 1-ethyl-2-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]sulfanylbenzimidazole-5-sulfonamide Traditional Name: 1-ethyl-2-[[2-keto-2-[(2S)-2-methylindolin-1-yl]ethyl]thio]benzimidazole-5-sulfonamide Formula: C20H22N4O3S2 MolecularWeight: 430.54368

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)N3C(CC4=CC=CC=C43)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)N3[C@H](CC4=CC=CC=C43)C

InChI

InChI=1S/C20H22N4O3S2/c1-3-23-18-9-8-15(29(21,26)27)11-16(18)22-20(23)28-12-19(25)24-13(2)10-14-6-4-5-7-17(14)24/h4-9,11,13H,3,10,12H2,1-2H3,(H2,21,26,27)/t13-/m0/s1