3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-ethyl-phenyl]-5-(trifluoromethyl)-1,2-oxazole

Systemtic Name: 3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-ethyl-phenyl]-5-(trifluoromethyl)-1,2-oxazole Openeye Name: 3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-ethyl-phenyl]-5-(trifluoromethyl)isoxazole CAS Name: 3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-ethylphenyl]-5-(trifluoromethyl)isoxazole IUPAC Name: 3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-ethylphenyl]-5-(trifluoromethyl)-1,2-oxazole Traditional Name: 3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-ethyl-phenyl]-5-(trifluoromethyl)isoxazole Formula: C21H19F3N2O3S MolecularWeight: 436.44737

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C2=NOC(=C2)C(F)(F)F)S(=O)(=O)N3CCCC4=CC=CC=C43

Isomeric SMILES

CCC1=C(C=C(C=C1)C2=NOC(=C2)C(F)(F)F)S(=O)(=O)N3CCCC4=CC=CC=C43

InChI

InChI=1S/C21H19F3N2O3S/c1-2-14-9-10-16(17-13-20(29-25-17)21(22,23)24)12-19(14)30(27,28)26-11-5-7-15-6-3-4-8-18(15)26/h3-4,6,8-10,12-13H,2,5,7,11H2,1H3