Vitas-M small molecule compound
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Catalog ID
STL396895
SMILES COc1cc(CCNC(=O)c2onc(n2)Cn2nc(cc2C)[N+](=O)[O-])ccc1OC
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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 C18H20N6O6 MW 416.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N6O6/c1-11-8-16(24(26)27)21-23(11)10-15-20-18(30-22-15)17(25)19-7-6-12-4-5-13(28-2)14(9-12)29-3/h4-5,8-9H,6-7,10H2,1-3H3,(H,19,25)InChIKey
REDICILBVHURLI-UHFFFAOYSA-NSynonyms
1005663-04-61005663046
CC1=CC(=NN1CC2=NOC(=N2)C(=O)NCCC3=CC(=C(C=C3)OC)OC)(N+)(=O)(O)
COc1cc(CCNC(=O)c2onc(n2)Cn2nc(cc2C)(N+)(=O)(O))ccc1OC
InChI=1SC18H20N6O6c111816(24(26)27)2123(11)10152018(302215)17(25)1976124513(282)14(912)293h4589H6710H213H3(H1925)
MFCD06197173
N(2(34DIMETHOXYPHENYL)ETHYL)3((5METHYL3NITRO1HPYRAZOL1YL)METHYL)124OXADIAZOLE5CARBOXAMIDE
N(2(34dimethoxyphenyl)ethyl)3((5methyl3nitropyrazol1yl)methyl)124oxadiazole5carboxamide
ZINC000017090539
ZINC17090539
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