4-[[1-(4-fluorophenyl)-2-methyl-5-(4-methylsulfonylphenyl)pyrrol-3-yl]methoxy]aniline

Systemtic Name: 4-[[1-(4-fluorophenyl)-2-methyl-5-(4-methylsulfonylphenyl)pyrrol-3-yl]methoxy]aniline Openeye Name: 4-[[1-(4-fluorophenyl)-2-methyl-5-(4-methylsulfonylphenyl)pyrrol-3-yl]methoxy]aniline CAS Name: 4-[[1-(4-fluorophenyl)-2-methyl-5-(4-methylsulfonylphenyl)-3-pyrrolyl]methoxy]aniline IUPAC Name: 4-[[1-(4-fluorophenyl)-2-methyl-5-(4-methylsulfonylphenyl)pyrrol-3-yl]methoxy]aniline Traditional Name: [4-[[1-(4-fluorophenyl)-5-(4-mesylphenyl)-2-methyl-pyrrol-3-yl]methoxy]phenyl]amine Formula: C25H23FN2O3S MolecularWeight: 450.525123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C2=CC=C(C=C2)F)C3=CC=C(C=C3)S(=O)(=O)C)COC4=CC=C(C=C4)N

Isomeric SMILES

CC1=C(C=C(N1C2=CC=C(C=C2)F)C3=CC=C(C=C3)S(=O)(=O)C)COC4=CC=C(C=C4)N

InChI

InChI=1S/C25H23FN2O3S/c1-17-19(16-31-23-11-7-21(27)8-12-23)15-25(28(17)22-9-5-20(26)6-10-22)18-3-13-24(14-4-18)32(2,29)30/h3-15H,16,27H2,1-2H3