3-[(5-bromanyl-1-cyclopropylcarbonyl-2,3-dihydroindol-7-yl)sulfonyl]-N-(3-fluoranyl-4-methyl-phenyl)propanamide

Systemtic Name: 3-[(5-bromanyl-1-cyclopropylcarbonyl-2,3-dihydroindol-7-yl)sulfonyl]-N-(3-fluoranyl-4-methyl-phenyl)propanamide Openeye Name: 3-[5-bromo-1-(cyclopropanecarbonyl)indolin-7-yl]sulfonyl-N-(3-fluoro-4-methyl-phenyl)propanamide CAS Name: 3-[[5-bromo-1-[cyclopropyl(oxo)methyl]-2,3-dihydroindol-7-yl]sulfonyl]-N-(3-fluoro-4-methylphenyl)propanamide IUPAC Name: 3-[[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydroindol-7-yl]sulfonyl]-N-(3-fluoro-4-methylphenyl)propanamide Traditional Name: 3-[5-bromo-1-(cyclopropanecarbonyl)indolin-7-yl]sulfonyl-N-(3-fluoro-4-methyl-phenyl)propionamide Formula: C22H22BrFN2O4S MolecularWeight: 509.388483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCS(=O)(=O)C2=C3C(=CC(=C2)Br)CCN3C(=O)C4CC4)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCS(=O)(=O)C2=C3C(=CC(=C2)Br)CCN3C(=O)C4CC4)F

InChI

InChI=1S/C22H22BrFN2O4S/c1-13-2-5-17(12-18(13)24)25-20(27)7-9-31(29,30)19-11-16(23)10-15-6-8-26(21(15)19)22(28)14-3-4-14/h2,5,10-12,14H,3-4,6-9H2,1H3,(H,25,27)