Vitas-M small molecule compound
ethyl 2-[(4-chloro-3,5-dimethylphenoxy)methyl]-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Catalog ID
STL177019
SMILES CCOC(=O)c1sc2c(c1C)c1nc(nn1cn2)COc1cc(C)c(c(c1)C)Cl
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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 C20H19ClN4O3S MW 430.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN4O3S/c1-5-27-20(26)17-12(4)15-18-23-14(24-25(18)9-22-19(15)29-17)8-28-13-6-10(2)16(21)11(3)7-13/h6-7,9H,5,8H2,1-4H3InChIKey
CMWRUYLZGLLAIY-UHFFFAOYSA-NSynonyms
828283-42-7828283427
CCOC(=O)C1=C(C2=C(S1)N=CN3C2=NC(=N3)COC4=CC(=C(C(=C4)C)Cl)C)C
ethyl2((4chloro35dimethylphenoxy)methyl)9methylthieno(32e)(124)triazolo(15c)pyrimidine8carboxylate
InChI=1SC20H19ClN4O3Sc152720(26)1712(4)15182314(2425(18)92219(15)2917)82813610(2)16(21)11(3)713h679H58H214H3
MFCD04130135
ZINC000002791551
ZINC02791551
ZINC2791551
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