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

Systemtic Name: 1-[(5-bromanyl-1-propanoyl-2,3-dihydroindol-7-yl)sulfonyl]-N-phenethyl-piperidine-3-carboxamide Openeye Name: 1-(5-bromo-1-propanoyl-indolin-7-yl)sulfonyl-N-phenethyl-piperidine-3-carboxamide CAS Name: 1-[[5-bromo-1-(1-oxopropyl)-2,3-dihydroindol-7-yl]sulfonyl]-N-phenethyl-3-piperidinecarboxamide IUPAC Name: 1-[(5-bromo-1-propanoyl-2,3-dihydroindol-7-yl)sulfonyl]-N-phenethylpiperidine-3-carboxamide Traditional Name: 1-(5-bromo-1-propionyl-indolin-7-yl)sulfonyl-N-phenethyl-nipecotamide Formula: C25H30BrN3O4S MolecularWeight: 548.4924

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)N3CCCC(C3)C(=O)NCCC4=CC=CC=C4)Br

Isomeric SMILES

CCC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)N3CCCC(C3)C(=O)NCCC4=CC=CC=C4)Br

InChI

InChI=1S/C25H30BrN3O4S/c1-2-23(30)29-14-11-19-15-21(26)16-22(24(19)29)34(32,33)28-13-6-9-20(17-28)25(31)27-12-10-18-7-4-3-5-8-18/h3-5,7-8,15-16,20H,2,6,9-14,17H2,1H3,(H,27,31)