N-(3-bicyclo[3.2.1]octanyl)-7-bromanyl-2-methyl-1-(3-methylsulfonylpropyl)indole-3-carboxamide

Systemtic Name: N-(3-bicyclo[3.2.1]octanyl)-7-bromanyl-2-methyl-1-(3-methylsulfonylpropyl)indole-3-carboxamide Openeye Name: N-(3-bicyclo[3.2.1]octanyl)-7-bromo-2-methyl-1-(3-methylsulfonylpropyl)indole-3-carboxamide CAS Name: N-(3-bicyclo[3.2.1]octanyl)-7-bromo-2-methyl-1-(3-methylsulfonylpropyl)-3-indolecarboxamide IUPAC Name: N-(3-bicyclo[3.2.1]octanyl)-7-bromo-2-methyl-1-(3-methylsulfonylpropyl)indole-3-carboxamide Traditional Name: N-(3-bicyclo[3.2.1]octanyl)-7-bromo-1-(3-mesylpropyl)-2-methyl-indole-3-carboxamide Formula: C22H29BrN2O3S MolecularWeight: 481.44626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CCCS(=O)(=O)C)C(=CC=C2)Br)C(=O)NC3CC4CCC(C4)C3

Isomeric SMILES

CC1=C(C2=C(N1CCCS(=O)(=O)C)C(=CC=C2)Br)C(=O)NC3CC4CCC(C4)C3

InChI

InChI=1S/C22H29BrN2O3S/c1-14-20(22(26)24-17-12-15-7-8-16(11-15)13-17)18-5-3-6-19(23)21(18)25(14)9-4-10-29(2,27)28/h3,5-6,15-17H,4,7-13H2,1-2H3,(H,24,26)