N-(5-bromanylpyridin-2-yl)-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(5-bromo-2-pyridyl)-1-[(5-methyl-2-thienyl)sulfonyl]piperidine-4-carboxamide CAS Name: N-(5-bromo-2-pyridinyl)-1-[(5-methyl-2-thiophenyl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(5-bromopyridin-2-yl)-1-(5-methylthiophen-2-yl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(5-bromo-2-pyridyl)-1-[(5-methyl-2-thienyl)sulfonyl]isonipecotamide Formula: C16H18BrN3O3S2 MolecularWeight: 444.36642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NC=C(C=C3)Br

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NC=C(C=C3)Br

InChI

InChI=1S/C16H18BrN3O3S2/c1-11-2-5-15(24-11)25(22,23)20-8-6-12(7-9-20)16(21)19-14-4-3-13(17)10-18-14/h2-5,10,12H,6-9H2,1H3,(H,18,19,21)