N-(4-pyrrol-1-ylphenyl)-3,5-bis(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-(4-pyrrol-1-ylphenyl)-3,5-bis(trifluoromethyl)benzenesulfonamide Openeye Name: N-(4-pyrrol-1-ylphenyl)-3,5-bis(trifluoromethyl)benzenesulfonamide CAS Name: N-[4-(1-pyrrolyl)phenyl]-3,5-bis(trifluoromethyl)benzenesulfonamide IUPAC Name: N-(4-pyrrol-1-ylphenyl)-3,5-bis(trifluoromethyl)benzenesulfonamide Traditional Name: N-(4-pyrrol-1-ylphenyl)-3,5-bis(trifluoromethyl)benzenesulfonamide Formula: C18H12F6N2O2S MolecularWeight: 434.355499

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CN(C=C1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C18H12F6N2O2S/c19-17(20,21)12-9-13(18(22,23)24)11-16(10-12)29(27,28)25-14-3-5-15(6-4-14)26-7-1-2-8-26/h1-11,25H