Vitas-M small molecule compound
ethyl 3-amino-5-(1,3-benzodioxol-5-yl)-2-cyano-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK728800
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc3c(c1)OCO3)c(N)c(s2)C#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 C18H16N4O4S MW 384.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O4S/c1-3-24-17(23)14-9(2)21-18-22(16(20)13(7-19)27-18)15(14)10-4-5-11-12(6-10)26-8-25-11/h4-6,15H,3,8,20H2,1-2H3InChIKey
DGIFHJVTLMBVEY-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N=C2N(C1C3=CC4=C(C=C3)OCO4)C(=C(S2)C#N)N)C
ethyl3amino5(13benzodioxol5yl)2cyano7methyl5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC18H16N4O4Sc132417(23)149(2)211822(16(20)13(719)2718)15(14)10451112(610)2682511h4615H3820H212H3
MFCD06753062
ZINC000004502854
ZINC000004502856
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