Vitas-M small molecule compound
methyl (2Z)-{2-[(5-butyl-1,3,5-triazinan-2-ylidene)amino]-4-oxo-1,3-thiazol-5(4H)-ylidene}ethanoate
Catalog ID
STL576915
SMILES CCCCN1CNC(=NC2=NC(=O)/C(=C/C(=O)OC)/S2)NC1
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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 C13H19N5O3S MW 325.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H19N5O3S/c1-3-4-5-18-7-14-12(15-8-18)17-13-16-11(20)9(22-13)6-10(19)21-2/h6H,3-5,7-8H2,1-2H3,(H2,14,15,16,17,20)/b9-6-InChIKey
NCUVOJHDGFGERP-TWGQIWQCSA-NSynonyms
145916684
InChI=1SC13H19N5O3Sc13451871412(15818)17131611(20)9(2213)610(19)212h6H3578H212H3(H21415161720)b96
methyl(2Z)(2((5butyl135triazinan2ylidene)amino)4oxo13thiazol5(4H)ylidene)ethanoate
methyl(2Z)2((2E)2((3butyl24dihydro1H135triazin6yl)imino)4oxo13thiazolidin5ylidene)acetate
MFCD32650522
ZINC001848442885
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