N-[4,5-dimethyl-3-(4-methylphenyl)sulfonyl-1-(2-methylpropyl)pyrrol-2-yl]-2-fluoranyl-benzamide

Systemtic Name: N-[4,5-dimethyl-3-(4-methylphenyl)sulfonyl-1-(2-methylpropyl)pyrrol-2-yl]-2-fluoranyl-benzamide Openeye Name: 2-fluoro-N-[1-isobutyl-4,5-dimethyl-3-(p-tolylsulfonyl)pyrrol-2-yl]benzamide CAS Name: N-[4,5-dimethyl-3-(4-methylphenyl)sulfonyl-1-(2-methylpropyl)-2-pyrrolyl]-2-fluorobenzamide IUPAC Name: N-[4,5-dimethyl-3-(4-methylphenyl)sulfonyl-1-(2-methylpropyl)pyrrol-2-yl]-2-fluorobenzamide Traditional Name: 2-fluoro-N-(1-isobutyl-4,5-dimethyl-3-tosyl-pyrrol-2-yl)benzamide Formula: C24H27FN2O3S MolecularWeight: 442.546183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C(=C2C)C)CC(C)C)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C(=C2C)C)CC(C)C)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C24H27FN2O3S/c1-15(2)14-27-18(5)17(4)22(31(29,30)19-12-10-16(3)11-13-19)23(27)26-24(28)20-8-6-7-9-21(20)25/h6-13,15H,14H2,1-5H3,(H,26,28)