N-ethyl-4-[3-(3-methylsulfonylphenoxy)phenyl]-8-(trifluoromethyl)quinoline-3-carboxamide

Systemtic Name: N-ethyl-4-[3-(3-methylsulfonylphenoxy)phenyl]-8-(trifluoromethyl)quinoline-3-carboxamide Openeye Name: N-ethyl-4-[3-(3-methylsulfonylphenoxy)phenyl]-8-(trifluoromethyl)quinoline-3-carboxamide CAS Name: N-ethyl-4-[3-(3-methylsulfonylphenoxy)phenyl]-8-(trifluoromethyl)-3-quinolinecarboxamide IUPAC Name: N-ethyl-4-[3-(3-methylsulfonylphenoxy)phenyl]-8-(trifluoromethyl)quinoline-3-carboxamide Traditional Name: N-ethyl-4-[3-(3-mesylphenoxy)phenyl]-8-(trifluoromethyl)quinoline-3-carboxamide Formula: C26H21F3N2O4S MolecularWeight: 514.51615

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CN=C2C(=C1C3=CC(=CC=C3)OC4=CC(=CC=C4)S(=O)(=O)C)C=CC=C2C(F)(F)F

Isomeric SMILES

CCNC(=O)C1=CN=C2C(=C1C3=CC(=CC=C3)OC4=CC(=CC=C4)S(=O)(=O)C)C=CC=C2C(F)(F)F

InChI

InChI=1S/C26H21F3N2O4S/c1-3-30-25(32)21-15-31-24-20(11-6-12-22(24)26(27,28)29)23(21)16-7-4-8-17(13-16)35-18-9-5-10-19(14-18)36(2,33)34/h4-15H,3H2,1-2H3,(H,30,32)