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

Systemtic Name: 3-[(5-bromanyl-1-cyclopropylcarbonyl-2,3-dihydroindol-7-yl)sulfonyl]-N-[(4-methoxyphenyl)methyl]propanamide Openeye Name: 3-[5-bromo-1-(cyclopropanecarbonyl)indolin-7-yl]sulfonyl-N-[(4-methoxyphenyl)methyl]propanamide CAS Name: 3-[[5-bromo-1-[cyclopropyl(oxo)methyl]-2,3-dihydroindol-7-yl]sulfonyl]-N-[(4-methoxyphenyl)methyl]propanamide IUPAC Name: 3-[[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydroindol-7-yl]sulfonyl]-N-[(4-methoxyphenyl)methyl]propanamide Traditional Name: 3-[5-bromo-1-(cyclopropanecarbonyl)indolin-7-yl]sulfonyl-N-p-anisyl-propionamide Formula: C23H25BrN2O5S MolecularWeight: 521.424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)CCS(=O)(=O)C2=C3C(=CC(=C2)Br)CCN3C(=O)C4CC4

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)CCS(=O)(=O)C2=C3C(=CC(=C2)Br)CCN3C(=O)C4CC4

InChI

InChI=1S/C23H25BrN2O5S/c1-31-19-6-2-15(3-7-19)14-25-21(27)9-11-32(29,30)20-13-18(24)12-17-8-10-26(22(17)20)23(28)16-4-5-16/h2-3,6-7,12-13,16H,4-5,8-11,14H2,1H3,(H,25,27)