Vitas-M small molecule compound
4-[(E)-{2-[(4-amino-1,2,5-oxadiazol-3-yl)carbonyl]hydrazinylidene}methyl]-2-methoxyphenyl 4-fluorobenzenesulfonate
Catalog ID
STK762616
SMILES COc1cc(/C=N/NC(=O)c2nonc2N)ccc1OS(=O)(=O)c1ccc(cc1)F
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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 C17H14FN5O6S MW 435.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14FN5O6S/c1-27-14-8-10(9-20-21-17(24)15-16(19)23-29-22-15)2-7-13(14)28-30(25,26)12-5-3-11(18)4-6-12/h2-9H,1H3,(H2,19,23)(H,21,24)/b20-9+InChIKey
KIPKQMMXQHFNRV-AWQFTUOYSA-NSynonyms
(4((E)((4amino125oxadiazole3carbonyl)hydrazinylidene)methyl)2methoxyphenyl)4fluorobenzenesulfonate
4((E)(2((4amino125oxadiazol3yl)carbonyl)hydrazinylidene)methyl)2methoxyphenyl4fluorobenzenesulfonate
COC1=C(C=CC(=C1)C=NNC(=O)C2=NON=C2N)OS(=O)(=O)C3=CC=C(C=C3)F
COc1cc(C=NNC(=O)c2nonc2N)ccc1OS(=O)(=O)c1ccc(cc1)F
InChI=1SC17H14FN5O6Sc12714810(9202117(24)1516(19)23292215)2713(14)2830(2526)125311(18)4612h29H1H3(H21923)(H2124)b209+
MFCD01872304
ZINC000008854758
ZINC33454653
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