Vitas-M small molecule compound
N'-[(E)-1,3-benzodioxol-5-ylmethylidene]-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carbohydrazide
Catalog ID
STK557061
SMILES O=C(C12CCC(C2(C)C)(C(=O)O1)C)N/N=C/c1ccc2c(c1)OCO2
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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 C18H20N2O5 MW 344.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O5/c1-16(2)17(3)6-7-18(16,25-15(17)22)14(21)20-19-9-11-4-5-12-13(8-11)24-10-23-12/h4-5,8-9H,6-7,10H2,1-3H3,(H,20,21)/b19-9+InChIKey
CNCVZNPURRVSBS-DJKKODMXSA-NSynonyms
577990-28-4(1SE)N(benzo(d)(13)dioxol5ylmethylene)477trimethyl3oxo2oxabicyclo(221)heptane1carbohydrazide
577990284
CC1(C2(CCC1(OC2=O)C(=O)NN=CC3=CC4=C(C=C3)OCO4)C)C
InChI=1SC18H20N2O5c116(2)17(3)6718(162515(17)22)14(21)2019911451213(811)24102312h4589H6710H213H3(H2021)b199+
MFCD03504343
N((1E)2(2HBENZO(34D)13DIOXOLEN5YL)1AZAVINYL)(477TRIMETHYL3OXO2OXABICYCLO(221)HEPTYL)CARBOXAMIDE
N((E)13benzodioxol5ylmethylidene)477trimethyl3oxo2oxabicyclo(221)heptane1carbohydrazide
N((E)13benzodioxol5ylmethylideneamino)177trimethyl2oxo3oxabicyclo(221)heptane4carboxamide
O=C(C12CCC(C2(C)C)(C(=O)O1)C)NN=Cc1ccc2c(c1)OCO2
ZINC000005071710
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