Vitas-M small molecule compound
5-(azepan-1-ylcarbonyl)-1-methyl-1H-pyrazole-4-carboxylic acid
Catalog ID
STK350315
SMILES O=C(c1n(C)ncc1C(=O)O)N1CCCCCC1
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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 C12H17N3O3 MW 251.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H17N3O3/c1-14-10(9(8-13-14)12(17)18)11(16)15-6-4-2-3-5-7-15/h8H,2-7H2,1H3,(H,17,18)InChIKey
AFZVSRQSCVGWQB-UHFFFAOYSA-NSynonyms
1006455-42-01006455420
5(AZAPERHYDROEPINYLCARBONYL)1METHYLPYRAZOLE4CARBOXYLICACID
5(azepan1ylcarbonyl)1methyl1Hpyrazole4carboxylicacid
5(azepane1carbonyl)1methylpyrazole4carboxylicacid
CN1C(=C(C=N1)C(=O)O)C(=O)N2CCCCCC2
InChI=1SC12H17N3O3c11410(9(81314)12(17)18)11(16)1564235715h8H27H21H3(H1718)
MFCD06806558
ZINC000012357912
ZINC12357912
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