Vitas-M small molecule compound
2-ethoxy-4-[(Z)-(5-imino-7-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]phenyl thiophene-2-carboxylate
Catalog ID
STK129453
SMILES CCCc1nn2c(=NC(=O)/C(=C\c3ccc(c(c3)OCC)OC(=O)c3cccs3)/C2=N)s1
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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 C22H20N4O4S2 MW 468.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O4S2/c1-3-6-18-25-26-19(23)14(20(27)24-22(26)32-18)11-13-8-9-15(16(12-13)29-4-2)30-21(28)17-7-5-10-31-17/h5,7-12,23H,3-4,6H2,1-2H3/b14-11-,23-19-InChIKey
PACRMFNMVIAEMZ-WOLXQTQRSA-NSynonyms
2ethoxy4((Z)(5imino7oxo2propyl5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenylthiophene2carboxylate
CCCc1nn2c(=NC(=O)C(=Cc3ccc(c(c3)OCC)OC(=O)c3cccs3)C2=N)s1
MFCD08673214
ZINC000012631183
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