[(3S)-1-[[5-(benzimidazol-1-ylmethyl)-1H-pyrazol-3-yl]carbonyl]pyrrolidin-3-yl]-dimethyl-azanium

Systemtic Name: [(3S)-1-[[5-(benzimidazol-1-ylmethyl)-1H-pyrazol-3-yl]carbonyl]pyrrolidin-3-yl]-dimethyl-azanium Openeye Name: [(3S)-1-[5-(benzimidazol-1-ylmethyl)-1H-pyrazole-3-carbonyl]pyrrolidin-3-yl]-dimethyl-ammonium CAS Name: [(3S)-1-[[5-(1-benzimidazolylmethyl)-1H-pyrazol-3-yl]-oxomethyl]-3-pyrrolidinyl]-dimethylammonium IUPAC Name: [(3S)-1-[5-(benzimidazol-1-ylmethyl)-1H-pyrazole-3-carbonyl]pyrrolidin-3-yl]-dimethylazanium Traditional Name: [(3S)-1-[5-(benzimidazol-1-ylmethyl)-1H-pyrazole-3-carbonyl]pyrrolidin-3-yl]-dimethyl-ammonium Formula: C18H23N6O+ MolecularWeight: 339.41482

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C1CCN(C1)C(=O)C2=NNC(=C2)CN3C=NC4=CC=CC=C43

Isomeric SMILES

C[NH+](C)[C@H]1CCN(C1)C(=O)C2=NNC(=C2)CN3C=NC4=CC=CC=C43

InChI

InChI=1S/C18H22N6O/c1-22(2)14-7-8-23(11-14)18(25)16-9-13(20-21-16)10-24-12-19-15-5-3-4-6-17(15)24/h3-6,9,12,14H,7-8,10-11H2,1-2H3,(H,20,21)/p+1/t14-/m0/s1