(2S,4R)-4-(1H-benzimidazol-2-ylsulfanyl)-N-cyclopropyl-1-(2,3-dihydro-1H-inden-2-yl)pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S,4R)-4-(1H-benzimidazol-2-ylsulfanyl)-N-cyclopropyl-1-(2,3-dihydro-1H-inden-2-yl)pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S,4R)-4-(1H-benzimidazol-2-ylsulfanyl)-N-cyclopropyl-1-indan-2-yl-pyrrolidin-1-ium-2-carboxamide CAS Name: (2S,4R)-4-(1H-benzimidazol-2-ylthio)-N-cyclopropyl-1-(2,3-dihydro-1H-inden-2-yl)-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S,4R)-4-(1H-benzimidazol-2-ylsulfanyl)-N-cyclopropyl-1-(2,3-dihydro-1H-inden-2-yl)pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S,4R)-4-(1H-benzimidazol-2-ylthio)-N-cyclopropyl-1-indan-2-yl-pyrrolidin-1-ium-2-carboxamide Formula: C24H27N4OS+ MolecularWeight: 419.56238

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2CC(C[NH+]2C3CC4=CC=CC=C4C3)SC5=NC6=CC=CC=C6N5

Isomeric SMILES

C1CC1NC(=O)[C@@H]2C[C@H](C[NH+]2C3CC4=CC=CC=C4C3)SC5=NC6=CC=CC=C6N5

InChI

InChI=1S/C24H26N4OS/c29-23(25-17-9-10-17)22-13-19(30-24-26-20-7-3-4-8-21(20)27-24)14-28(22)18-11-15-5-1-2-6-16(15)12-18/h1-8,17-19,22H,9-14H2,(H,25,29)(H,26,27)/p+1/t19-,22+/m1/s1