4-methyl-3-morpholin-4-ylsulfonyl-N-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]benzenecarboximidate

Systemtic Name: 4-methyl-3-morpholin-4-ylsulfonyl-N-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]benzenecarboximidate Openeye Name: 4-methyl-3-morpholinosulfonyl-N-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]benzenecarboximidate CAS Name: 4-methyl-3-(4-morpholinylsulfonyl)-N-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]benzenecarboximidate IUPAC Name: 4-methyl-3-morpholin-4-ylsulfonyl-N-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]benzenecarboximidate Traditional Name: 4-methyl-3-morpholinosulfonyl-N-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]benzenecarboximidate Formula: C15H15F3N5O4S- MolecularWeight: 418.37091

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=NC2=NNC(=N2)C(F)(F)F)[O-])S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=NC2=NNC(=N2)C(F)(F)F)[O-])S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C15H16F3N5O4S/c1-9-2-3-10(8-11(9)28(25,26)23-4-6-27-7-5-23)12(24)19-14-20-13(21-22-14)15(16,17)18/h2-3,8H,4-7H2,1H3,(H2,19,20,21,22,24)/p-1