3-nitro-4-[2-oxidanylidene-2-[6-(trifluoromethyl)-3,4-dihydro-2H-quinolin-1-yl]ethyl]sulfanyl-benzamide

Systemtic Name: 3-nitro-4-[2-oxidanylidene-2-[6-(trifluoromethyl)-3,4-dihydro-2H-quinolin-1-yl]ethyl]sulfanyl-benzamide Openeye Name: 3-nitro-4-[2-oxo-2-[6-(trifluoromethyl)-3,4-dihydro-2H-quinolin-1-yl]ethyl]sulfanyl-benzamide CAS Name: 3-nitro-4-[[2-oxo-2-[6-(trifluoromethyl)-3,4-dihydro-2H-quinolin-1-yl]ethyl]thio]benzamide IUPAC Name: 3-nitro-4-[2-oxo-2-[6-(trifluoromethyl)-3,4-dihydro-2H-quinolin-1-yl]ethyl]sulfanylbenzamide Traditional Name: 4-[[2-keto-2-[6-(trifluoromethyl)-3,4-dihydro-2H-quinolin-1-yl]ethyl]thio]-3-nitro-benzamide Formula: C19H16F3N3O4S MolecularWeight: 439.40825

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)C(F)(F)F)N(C1)C(=O)CSC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1CC2=C(C=CC(=C2)C(F)(F)F)N(C1)C(=O)CSC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C19H16F3N3O4S/c20-19(21,22)13-4-5-14-11(8-13)2-1-7-24(14)17(26)10-30-16-6-3-12(18(23)27)9-15(16)25(28)29/h3-6,8-9H,1-2,7,10H2,(H2,23,27)