Vitas-M small molecule compound
N-(3,4-difluorophenyl)-1-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-5-methyl-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL129656
SMILES O=C(Cn1nnc(c1C)C(=O)Nc1ccc(c(c1)F)F)Nc1ccc2c(c1)OCCO2
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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 C20H17F2N5O4 MW 429.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17F2N5O4/c1-11-19(20(29)24-12-2-4-14(21)15(22)8-12)25-26-27(11)10-18(28)23-13-3-5-16-17(9-13)31-7-6-30-16/h2-5,8-9H,6-7,10H2,1H3,(H,23,28)(H,24,29)InChIKey
DXSVRHVBIYGVCU-UHFFFAOYSA-NSynonyms
CC1=C(N=NN1CC(=O)NC2=CC3=C(C=C2)OCCO3)C(=O)NC4=CC(=C(C=C4)F)F
InChI=1SC20H17F2N5O4c11119(20(29)24122414(21)15(22)812)252627(11)1018(28)2313351617(913)31763016h2589H6710H21H3(H2328)(H2429)
MFCD20747508
N(34difluorophenyl)1(2(23dihydro14benzodioxin6ylamino)2oxoethyl)5methyl1H123triazole4carboxamide
N(34difluorophenyl)1(2(23dihydro14benzodioxin6ylamino)2oxoethyl)5methyltriazole4carboxamide
ZINC000067322540
ZINC67322540
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