azanium (1Z)-4-chloranyl-N-[6-(3-methylpiperidin-1-yl)pyridin-3-yl]sulfonyl-2-(trifluoromethyl)benzenecarboximidate

Systemtic Name: azanium (1Z)-4-chloranyl-N-[6-(3-methylpiperidin-1-yl)pyridin-3-yl]sulfonyl-2-(trifluoromethyl)benzenecarboximidate Openeye Name: ammonium (1Z)-4-chloro-N-[[6-(3-methyl-1-piperidyl)-3-pyridyl]sulfonyl]-2-(trifluoromethyl)benzenecarboximidate CAS Name: ammonium (1Z)-4-chloro-N-[[6-(3-methyl-1-piperidinyl)-3-pyridinyl]sulfonyl]-2-(trifluoromethyl)benzenecarboximidate IUPAC Name: azanium (1Z)-4-chloro-N-[6-(3-methylpiperidin-1-yl)pyridin-3-yl]sulfonyl-2-(trifluoromethyl)benzenecarboximidate Traditional Name: ammonium (1Z)-4-chloro-N-[[6-(3-methylpiperidino)-3-pyridyl]sulfonyl]-2-(trifluoromethyl)benzenecarboximidate Formula: C19H22ClF3N4O3S MolecularWeight: 478.91619

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=NC=C(C=C2)S(=O)(=O)N=C(C3=C(C=C(C=C3)Cl)C(F)(F)F)[O-].[NH4+]

Isomeric SMILES

CC1CCCN(C1)C2=NC=C(C=C2)S(=O)(=O)/N=C(/C3=C(C=C(C=C3)Cl)C(F)(F)F)\[O-].[NH4+]

InChI

InChI=1S/C19H19ClF3N3O3S.H3N/c1-12-3-2-8-26(11-12)17-7-5-14(10-24-17)30(28,29)25-18(27)15-6-4-13(20)9-16(15)19(21,22)23;/h4-7,9-10,12H,2-3,8,11H2,1H3,(H,25,27);1H3