Vitas-M small molecule compound
4-amino-N-[2-(3,4-dimethoxyphenyl)ethyl]-1,2,5-oxadiazole-3-carboxamide 2-oxide
Catalog ID
STK780185
SMILES COc1cc(CCNC(=O)c2c(N)no[n+]2[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 C13H16N4O5 MW 308.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N4O5/c1-20-9-4-3-8(7-10(9)21-2)5-6-15-13(18)11-12(14)16-22-17(11)19/h3-4,7H,5-6H2,1-2H3,(H2,14,16)(H,15,18)InChIKey
WFGIXHLBPMEIHV-UHFFFAOYSA-NSynonyms
4aminoN(2(34dimethoxyphenyl)ethyl)125oxadiazole3carboxamide2oxide
4AMINON(2(34DIMETHOXYPHENYL)ETHYL)2OXIDO125OXADIAZOL2IUM3CARBOXAMIDE
COC1=C(C=C(C=C1)CCNC(=O)C2=(N+)(ON=C2N)(O))OC
COc1cc(CCNC(=O)c2c(N)no(n+)2(O))ccc1OC
InChI=1SC13H16N4O5c1209438(710(9)212)561513(18)1112(14)162217(11)19h347H56H212H3(H21416)(H1518)
MFCD05859848
ZINC000001430872
ZINC01430872
ZINC1430872
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