(2S,4R)-4-(1H-benzimidazol-2-ylsulfanyl)-N-cyclopropyl-1-[(E)-2-methylbut-2-enyl]pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S,4R)-4-(1H-benzimidazol-2-ylsulfanyl)-N-cyclopropyl-1-[(E)-2-methylbut-2-enyl]pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S,4R)-4-(1H-benzimidazol-2-ylsulfanyl)-N-cyclopropyl-1-[(E)-2-methylbut-2-enyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2S,4R)-4-(1H-benzimidazol-2-ylthio)-N-cyclopropyl-1-[(E)-2-methylbut-2-enyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S,4R)-4-(1H-benzimidazol-2-ylsulfanyl)-N-cyclopropyl-1-[(E)-2-methylbut-2-enyl]pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S,4R)-4-(1H-benzimidazol-2-ylthio)-N-cyclopropyl-1-[(E)-2-methylbut-2-enyl]pyrrolidin-1-ium-2-carboxamide Formula: C20H27N4OS+ MolecularWeight: 371.51958

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C[NH+]1CC(CC1C(=O)NC2CC2)SC3=NC4=CC=CC=C4N3

Isomeric SMILES

C/C=C(\C)/C[NH+]1C[C@@H](C[C@H]1C(=O)NC2CC2)SC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C20H26N4OS/c1-3-13(2)11-24-12-15(10-18(24)19(25)21-14-8-9-14)26-20-22-16-6-4-5-7-17(16)23-20/h3-7,14-15,18H,8-12H2,1-2H3,(H,21,25)(H,22,23)/p+1/b13-3+/t15-,18+/m1/s1