N-(1H-1,2,4-triazol-5-yl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboximidate

Systemtic Name: N-(1H-1,2,4-triazol-5-yl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboximidate Openeye Name: N-(1H-1,2,4-triazol-5-yl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboximidate CAS Name: N-(1H-1,2,4-triazol-5-yl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboximidate IUPAC Name: N-(1H-1,2,4-triazol-5-yl)-1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboximidate Traditional Name: N-(1H-1,2,4-triazol-5-yl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboximidate Formula: C15H15F3N5O3S- MolecularWeight: 402.37151

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=NC2=NC=NN2)[O-])S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCC1C(=NC2=NC=NN2)[O-])S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C15H16F3N5O3S/c16-15(17,18)11-2-1-3-12(8-11)27(25,26)23-6-4-10(5-7-23)13(24)21-14-19-9-20-22-14/h1-3,8-10H,4-7H2,(H2,19,20,21,22,24)/p-1