1-[(5-bromanyl-1-propanoyl-2,3-dihydroindol-7-yl)sulfonyl]-N-tert-butyl-piperidine-4-carboxamide

Systemtic Name: 1-[(5-bromanyl-1-propanoyl-2,3-dihydroindol-7-yl)sulfonyl]-N-tert-butyl-piperidine-4-carboxamide Openeye Name: 1-(5-bromo-1-propanoyl-indolin-7-yl)sulfonyl-N-tert-butyl-piperidine-4-carboxamide CAS Name: 1-[[5-bromo-1-(1-oxopropyl)-2,3-dihydroindol-7-yl]sulfonyl]-N-tert-butyl-4-piperidinecarboxamide IUPAC Name: 1-[(5-bromo-1-propanoyl-2,3-dihydroindol-7-yl)sulfonyl]-N-tert-butylpiperidine-4-carboxamide Traditional Name: 1-(5-bromo-1-propionyl-indolin-7-yl)sulfonyl-N-tert-butyl-isonipecotamide Formula: C21H30BrN3O4S MolecularWeight: 500.4496

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)N3CCC(CC3)C(=O)NC(C)(C)C)Br

Isomeric SMILES

CCC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)N3CCC(CC3)C(=O)NC(C)(C)C)Br

InChI

InChI=1S/C21H30BrN3O4S/c1-5-18(26)25-11-8-15-12-16(22)13-17(19(15)25)30(28,29)24-9-6-14(7-10-24)20(27)23-21(2,3)4/h12-14H,5-11H2,1-4H3,(H,23,27)