Vitas-M small molecule compound
ethyl 3-(azepan-1-ylsulfonyl)-1-methyl-1H-pyrazole-4-carboxylate
Catalog ID
STL104765
SMILES CCOC(=O)c1cn(nc1S(=O)(=O)N1CCCCCC1)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C13H21N3O4S MW 315.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H21N3O4S/c1-3-20-13(17)11-10-15(2)14-12(11)21(18,19)16-8-6-4-5-7-9-16/h10H,3-9H2,1-2H3InChIKey
JFURYUMUDHTBFD-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CN(N=C1S(=O)(=O)N2CCCCCC2)C
ethyl3(azepan1ylsulfonyl)1methyl1Hpyrazole4carboxylate
ethyl3(azepan1ylsulfonyl)1methylpyrazole4carboxylate
InChI=1SC13H21N3O4Sc132013(17)111015(2)1412(11)21(1819)1686457916h10H39H212H3
MFCD20736073
ZINC000067245717
ZINC67245717
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