(2S)-1-(4-fluorophenyl)sulfonyl-N-(1H-1,2,4-triazol-5-yl)pyrrolidine-2-carboximidate

Systemtic Name: (2S)-1-(4-fluorophenyl)sulfonyl-N-(1H-1,2,4-triazol-5-yl)pyrrolidine-2-carboximidate Openeye Name: (2S)-1-(4-fluorophenyl)sulfonyl-N-(1H-1,2,4-triazol-5-yl)pyrrolidine-2-carboximidate CAS Name: (2S)-1-(4-fluorophenyl)sulfonyl-N-(1H-1,2,4-triazol-5-yl)-2-pyrrolidinecarboximidate IUPAC Name: (2S)-1-(4-fluorophenyl)sulfonyl-N-(1H-1,2,4-triazol-5-yl)pyrrolidine-2-carboximidate Traditional Name: (2S)-1-(4-fluorophenyl)sulfonyl-N-(1H-1,2,4-triazol-5-yl)pyrrolidine-2-carboximidate Formula: C13H13FN5O3S- MolecularWeight: 338.337423

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=NC3=NC=NN3)[O-]

Isomeric SMILES

C1C[C@H](N(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=NC3=NC=NN3)[O-]

InChI

InChI=1S/C13H14FN5O3S/c14-9-3-5-10(6-4-9)23(21,22)19-7-1-2-11(19)12(20)17-13-15-8-16-18-13/h3-6,8,11H,1-2,7H2,(H2,15,16,17,18,20)/p-1/t11-/m0/s1