N-[3-fluoranyl-4-[1-[4-methyl-5-(4-methylphenyl)carbothioyl-1H-pyrrol-2-yl]ethyl]phenyl]methanesulfonamide

Systemtic Name: N-[3-fluoranyl-4-[1-[4-methyl-5-(4-methylphenyl)carbothioyl-1H-pyrrol-2-yl]ethyl]phenyl]methanesulfonamide Openeye Name: N-[3-fluoro-4-[1-[4-methyl-5-(4-methylbenzenecarbothioyl)-1H-pyrrol-2-yl]ethyl]phenyl]methanesulfonamide CAS Name: N-[3-fluoro-4-[1-[4-methyl-5-[(4-methylphenyl)-sulfanylidenemethyl]-1H-pyrrol-2-yl]ethyl]phenyl]methanesulfonamide IUPAC Name: N-[3-fluoro-4-[1-[4-methyl-5-(4-methylbenzenecarbothioyl)-1H-pyrrol-2-yl]ethyl]phenyl]methanesulfonamide Traditional Name: N-[3-fluoro-4-[1-[4-methyl-5-(4-methylthiobenzoyl)-1H-pyrrol-2-yl]ethyl]phenyl]methanesulfonamide Formula: C22H23FN2O2S2 MolecularWeight: 430.558623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=S)C2=C(C=C(N2)C(C)C3=C(C=C(C=C3)NS(=O)(=O)C)F)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=S)C2=C(C=C(N2)C(C)C3=C(C=C(C=C3)NS(=O)(=O)C)F)C

InChI

InChI=1S/C22H23FN2O2S2/c1-13-5-7-16(8-6-13)22(28)21-14(2)11-20(24-21)15(3)18-10-9-17(12-19(18)23)25-29(4,26)27/h5-12,15,24-25H,1-4H3