Vitas-M small molecule compound
ethyl 4-[(2-methylpropyl)sulfonyl]-6-nitro-1-phenyl-1H-indazole-3-carboxylate
Catalog ID
STK770257
SMILES CCOC(=O)c1nn(c2c1c(cc(c2)[N+](=O)[O-])S(=O)(=O)CC(C)C)c1ccccc1
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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 C20H21N3O6S MW 431.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O6S/c1-4-29-20(24)19-18-16(22(21-19)14-8-6-5-7-9-14)10-15(23(25)26)11-17(18)30(27,28)12-13(2)3/h5-11,13H,4,12H2,1-3H3InChIKey
VWXDVZVENSHAPO-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=NN(C2=CC(=CC(=C21)S(=O)(=O)CC(C)C)(N+)(=O)(O))C3=CC=CC=C3
CCOC(=O)c1nn(c2c1c(cc(c2)(N+)(=O)(O))S(=O)(=O)CC(C)C)c1ccccc1
ethyl4((2methylpropyl)sulfonyl)6nitro1phenyl1Hindazole3carboxylate
ETHYL4(2METHYLPROPYLSULFONYL)6NITRO1PHENYLINDAZOLE3CARBOXYLATE
InChI=1SC20H21N3O6Sc142920(24)191816(22(2119)148657914)1015(23(25)26)1117(18)30(2728)1213(2)3h51113H412H213H3
MFCD03765909
ZINC000001072699
ZINC01072699
ZINC1072699
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