N-[3-fluoranyl-4-[1-[5-(4-methoxyphenyl)carbonyl-4-methyl-1H-pyrrol-2-yl]ethyl]phenyl]-2-oxidanyl-ethanesulfonamide

Systemtic Name: N-[3-fluoranyl-4-[1-[5-(4-methoxyphenyl)carbonyl-4-methyl-1H-pyrrol-2-yl]ethyl]phenyl]-2-oxidanyl-ethanesulfonamide Openeye Name: N-[3-fluoro-4-[1-[5-(4-methoxybenzoyl)-4-methyl-1H-pyrrol-2-yl]ethyl]phenyl]-2-hydroxy-ethanesulfonamide CAS Name: N-[3-fluoro-4-[1-[5-[(4-methoxyphenyl)-oxomethyl]-4-methyl-1H-pyrrol-2-yl]ethyl]phenyl]-2-hydroxyethanesulfonamide IUPAC Name: N-[3-fluoro-4-[1-[5-(4-methoxybenzoyl)-4-methyl-1H-pyrrol-2-yl]ethyl]phenyl]-2-hydroxyethanesulfonamide Traditional Name: N-[3-fluoro-4-[1-(4-methyl-5-p-anisoyl-1H-pyrrol-2-yl)ethyl]phenyl]-2-hydroxy-ethanesulfonamide Formula: C23H25FN2O5S MolecularWeight: 460.518403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1)C(C)C2=C(C=C(C=C2)NS(=O)(=O)CCO)F)C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(NC(=C1)C(C)C2=C(C=C(C=C2)NS(=O)(=O)CCO)F)C(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H25FN2O5S/c1-14-12-21(25-22(14)23(28)16-4-7-18(31-3)8-5-16)15(2)19-9-6-17(13-20(19)24)26-32(29,30)11-10-27/h4-9,12-13,15,25-27H,10-11H2,1-3H3