N-(2-oxidanylsulfonothioyloxyethyl)-3-[4-(trifluoromethyl)quinolin-2-yl]oxy-propan-1-amine

Systemtic Name: N-(2-oxidanylsulfonothioyloxyethyl)-3-[4-(trifluoromethyl)quinolin-2-yl]oxy-propan-1-amine Openeye Name: N-(2-hydroxysulfonothioyloxyethyl)-3-[[4-(trifluoromethyl)-2-quinolyl]oxy]propan-1-amine CAS Name: N-(2-hydroxysulfonothioyloxyethyl)-3-[[4-(trifluoromethyl)-2-quinolinyl]oxy]-1-propanamine IUPAC Name: N-(2-hydroxysulfonothioyloxyethyl)-3-[4-(trifluoromethyl)quinolin-2-yl]oxypropan-1-amine Traditional Name: 2-hydroxysulfonothioyloxyethyl-[3-[[4-(trifluoromethyl)-2-quinolyl]oxy]propyl]amine Formula: C15H17F3N2O4S2 MolecularWeight: 410.43169

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)OCCCNCCOS(=O)(=S)O)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)OCCCNCCOS(=O)(=S)O)C(F)(F)F

InChI

InChI=1S/C15H17F3N2O4S2/c16-15(17,18)12-10-14(20-13-5-2-1-4-11(12)13)23-8-3-6-19-7-9-24-26(21,22)25/h1-2,4-5,10,19H,3,6-9H2,(H,21,22,25)