1-(5-bromanylthiophen-2-yl)sulfonyl-N-(6-methoxypyridin-3-yl)piperidine-4-carboxamide

Systemtic Name: 1-(5-bromanylthiophen-2-yl)sulfonyl-N-(6-methoxypyridin-3-yl)piperidine-4-carboxamide Openeye Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-(6-methoxy-3-pyridyl)piperidine-4-carboxamide CAS Name: 1-[(5-bromo-2-thiophenyl)sulfonyl]-N-(6-methoxy-3-pyridinyl)-4-piperidinecarboxamide IUPAC Name: 1-(5-bromothiophen-2-yl)sulfonyl-N-(6-methoxypyridin-3-yl)piperidine-4-carboxamide Traditional Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-(6-methoxy-3-pyridyl)isonipecotamide Formula: C16H18BrN3O4S2 MolecularWeight: 460.36582

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

COC1=NC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C16H18BrN3O4S2/c1-24-14-4-2-12(10-18-14)19-16(21)11-6-8-20(9-7-11)26(22,23)15-5-3-13(17)25-15/h2-5,10-11H,6-9H2,1H3,(H,19,21)