N-[3-fluoranyl-4-[[5-(4-methoxyphenyl)carbonyl-1,4-dimethyl-pyrrol-2-yl]methyl]phenyl]ethenesulfonamide

Systemtic Name: N-[3-fluoranyl-4-[[5-(4-methoxyphenyl)carbonyl-1,4-dimethyl-pyrrol-2-yl]methyl]phenyl]ethenesulfonamide Openeye Name: N-[3-fluoro-4-[[5-(4-methoxybenzoyl)-1,4-dimethyl-pyrrol-2-yl]methyl]phenyl]ethenesulfonamide CAS Name: N-[3-fluoro-4-[[5-[(4-methoxyphenyl)-oxomethyl]-1,4-dimethyl-2-pyrrolyl]methyl]phenyl]ethenesulfonamide IUPAC Name: N-[3-fluoro-4-[[5-(4-methoxybenzoyl)-1,4-dimethylpyrrol-2-yl]methyl]phenyl]ethenesulfonamide Traditional Name: N-[4-[(1,4-dimethyl-5-p-anisoyl-pyrrol-2-yl)methyl]-3-fluoro-phenyl]ethenesulfonamide Formula: C23H23FN2O4S MolecularWeight: 442.503123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1)CC2=C(C=C(C=C2)NS(=O)(=O)C=C)F)C)C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(N(C(=C1)CC2=C(C=C(C=C2)NS(=O)(=O)C=C)F)C)C(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H23FN2O4S/c1-5-31(28,29)25-18-9-6-17(21(24)14-18)13-19-12-15(2)22(26(19)3)23(27)16-7-10-20(30-4)11-8-16/h5-12,14,25H,1,13H2,2-4H3