Vitas-M small molecule compound
N-[3-(3-nitro-1H-pyrazol-1-yl)propyl]-2-[3-(trifluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]butanamide
Catalog ID
STL399640
SMILES CCC(n1nc(c2c1CCC2)C(F)(F)F)C(=O)NCCCn1ccc(n1)[N+](=O)[O-]
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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 C17H21F3N6O3 MW 414.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21F3N6O3/c1-2-12(25-13-6-3-5-11(13)15(23-25)17(18,19)20)16(27)21-8-4-9-24-10-7-14(22-24)26(28)29/h7,10,12H,2-6,8-9H2,1H3,(H,21,27)InChIKey
RWWDYOAGVIXDDT-UHFFFAOYSA-NSynonyms
1006993-79-81006993798
CCC(C(=O)NCCCN1C=CC(=N1)(N+)(=O)(O))N2C3=C(CCC3)C(=N2)C(F)(F)F
CCC(n1nc(c2c1CCC2)C(F)(F)F)C(=O)NCCCn1ccc(n1)(N+)(=O)(O)
InChI=1SC17H21F3N6O3c1212(251363511(13)15(2325)17(1819)20)16(27)218492410714(2224)26(28)29h71012H2689H21H3(H2127)
MFCD08555285
N(3(3NITRO1HPYRAZOL1YL)PROPYL)2(3(TRIFLUOROMETHYL)56DIHYDROCYCLOPENTA(C)PYRAZOL1(4H)YL)BUTANAMIDE
N(3(3nitropyrazol1yl)propyl)2(3(trifluoromethyl)56dihydro4Hcyclopenta(c)pyrazol1yl)butanamide
ZINC000020607702
ZINC000020607703
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