N-[3,5-bis(trifluoromethyl)phenyl]isoquinoline-5-sulfonamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]isoquinoline-5-sulfonamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]isoquinoline-5-sulfonamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-5-isoquinolinesulfonamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]isoquinoline-5-sulfonamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]isoquinoline-5-sulfonamide Formula: C17H10F6N2O2S MolecularWeight: 420.328919

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C17H10F6N2O2S/c18-16(19,20)11-6-12(17(21,22)23)8-13(7-11)25-28(26,27)15-3-1-2-10-9-24-5-4-14(10)15/h1-9,25H