Vitas-M small molecule compound
2-ethoxy-4-{(E)-[5-iminio-7-oxo-2-(pyridin-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}phenolate
Catalog ID
STL147831
SMILES CCOc1cc(ccc1[O-])/C=C\1/C(=O)N=c2n(C1=[NH2+])nc(s2)c1cccnc1
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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 C19H15N5O3S MW 393.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N5O3S/c1-2-27-15-9-11(5-6-14(15)25)8-13-16(20)24-19(22-17(13)26)28-18(23-24)12-4-3-7-21-10-12/h3-10,20,25H,2H2,1H3/b13-8+,20-16?InChIKey
KOMNFBUJPPUZBA-HOMCDIFHSA-NSynonyms
2ethoxy4((E)(5iminio7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenolate
CCOc1cc(ccc1(O))C=C1C(=O)N=c2n(C1=(NH2+))nc(s2)c1cccnc1
MFCD04013529
ZINC000004646229
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