1-(5-bromanylthiophen-2-yl)sulfonyl-N-[2-(2-methylpropanoylamino)ethyl]piperidine-4-carboxamide

Systemtic Name: 1-(5-bromanylthiophen-2-yl)sulfonyl-N-[2-(2-methylpropanoylamino)ethyl]piperidine-4-carboxamide Openeye Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-[2-(2-methylpropanoylamino)ethyl]piperidine-4-carboxamide CAS Name: 1-[(5-bromo-2-thiophenyl)sulfonyl]-N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(5-bromothiophen-2-yl)sulfonyl-N-[2-(2-methylpropanoylamino)ethyl]piperidine-4-carboxamide Traditional Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-[2-(isobutyrylamino)ethyl]isonipecotamide Formula: C16H24BrN3O4S2 MolecularWeight: 466.41346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(S2)Br

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C16H24BrN3O4S2/c1-11(2)15(21)18-7-8-19-16(22)12-5-9-20(10-6-12)26(23,24)14-4-3-13(17)25-14/h3-4,11-12H,5-10H2,1-2H3,(H,18,21)(H,19,22)