2-[(2R)-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]-1-oxidanylidene-propan-2-yl]sulfanyl-1-propyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[(2R)-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]-1-oxidanylidene-propan-2-yl]sulfanyl-1-propyl-benzimidazole-5-sulfonamide Openeye Name: 2-[(1R)-1-methyl-2-[(2R)-2-methylindolin-1-yl]-2-oxo-ethyl]sulfanyl-1-propyl-benzimidazole-5-sulfonamide CAS Name: 2-[[(2R)-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]-1-oxopropan-2-yl]thio]-1-propyl-5-benzimidazolesulfonamide IUPAC Name: 2-[(2R)-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]-1-oxopropan-2-yl]sulfanyl-1-propylbenzimidazole-5-sulfonamide Traditional Name: 2-[[(1R)-2-keto-1-methyl-2-[(2R)-2-methylindolin-1-yl]ethyl]thio]-1-propyl-benzimidazole-5-sulfonamide Formula: C22H26N4O3S2 MolecularWeight: 458.59684

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C)C(=O)N3C(CC4=CC=CC=C43)C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1S[C@H](C)C(=O)N3[C@@H](CC4=CC=CC=C43)C

InChI

InChI=1S/C22H26N4O3S2/c1-4-11-25-20-10-9-17(31(23,28)29)13-18(20)24-22(25)30-15(3)21(27)26-14(2)12-16-7-5-6-8-19(16)26/h5-10,13-15H,4,11-12H2,1-3H3,(H2,23,28,29)/t14-,15-/m1/s1