N-[3-bromanyl-5-[6-(trifluoromethyl)-3,4-dihydroisoquinolin-1-yl]phenyl]-4-chloranyl-thiophene-2-sulfonamide

Systemtic Name: N-[3-bromanyl-5-[6-(trifluoromethyl)-3,4-dihydroisoquinolin-1-yl]phenyl]-4-chloranyl-thiophene-2-sulfonamide Openeye Name: N-[3-bromo-5-[6-(trifluoromethyl)-3,4-dihydroisoquinolin-1-yl]phenyl]-4-chloro-thiophene-2-sulfonamide CAS Name: N-[3-bromo-5-[6-(trifluoromethyl)-3,4-dihydroisoquinolin-1-yl]phenyl]-4-chloro-2-thiophenesulfonamide IUPAC Name: N-[3-bromo-5-[6-(trifluoromethyl)-3,4-dihydroisoquinolin-1-yl]phenyl]-4-chlorothiophene-2-sulfonamide Traditional Name: N-[3-bromo-5-[6-(trifluoromethyl)-3,4-dihydroisoquinolin-1-yl]phenyl]-4-chloro-thiophene-2-sulfonamide Formula: C20H13BrClF3N2O2S2 MolecularWeight: 549.81163

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(C2=C1C=C(C=C2)C(F)(F)F)C3=CC(=CC(=C3)Br)NS(=O)(=O)C4=CC(=CS4)Cl

Isomeric SMILES

C1CN=C(C2=C1C=C(C=C2)C(F)(F)F)C3=CC(=CC(=C3)Br)NS(=O)(=O)C4=CC(=CS4)Cl

InChI

InChI=1S/C20H13BrClF3N2O2S2/c21-14-6-12(7-16(8-14)27-31(28,29)18-9-15(22)10-30-18)19-17-2-1-13(20(23,24)25)5-11(17)3-4-26-19/h1-2,5-10,27H,3-4H2