Vitas-M small molecule compound
N,N-bis(cyanomethyl)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxamide
Catalog ID
STK845183
SMILES N#CCN(C(=O)C12CCC(C2(C)C)(C(=O)O1)C)CC#N
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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 C14H17N3O3 MW 275.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17N3O3/c1-12(2)13(3)4-5-14(12,20-11(13)19)10(18)17(8-6-15)9-7-16/h4-5,8-9H2,1-3H3InChIKey
CWEKPXUPSQVBBT-UHFFFAOYSA-NSynonyms
613658-61-0(1S4S)NNbis(cyanomethyl)477trimethyl3oxo2oxabicyclo(221)heptane1carboxamide
613658610
CC1(C2(CCC1(OC2=O)C(=O)N(CC#N)CC#N)C)C
InChI=1SC14H17N3O3c112(2)13(3)4514(122011(13)19)10(18)17(8615)9716h4589H213H3
MFCD03731249
NNBIS(CYANOMETHYL)(477TRIMETHYL3OXO2OXABICYCLO(221)HEPTYL)CARBOXAMIDE
NNBIS(CYANOMETHYL)177TRIMETHYL2OXO3OXABICYCLO(221)HEPTANE4CARBOXAMIDE
NNbis(cyanomethyl)477trimethyl3oxo2oxabicyclo(221)heptane1carboxamide
ZINC000000351797
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