Vitas-M small molecule compound
4-(4-methyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-(3,4,5-trimethoxyphenyl)butanamide
Catalog ID
STL135070
SMILES COc1cc(NC(=O)CCCc2nnc3n2c2ccsc2c(=O)n3C)cc(c1OC)OC
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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 C21H23N5O5S MW 457.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O5S/c1-25-20(28)19-13(8-9-32-19)26-16(23-24-21(25)26)6-5-7-17(27)22-12-10-14(29-2)18(31-4)15(11-12)30-3/h8-11H,5-7H2,1-4H3,(H,22,27)InChIKey
WLCTYKNZJYDRRZ-UHFFFAOYSA-NSynonyms
892752-70-44(4methyl5oxo45dihydrothieno(23e)(124)triazolo(43a)pyrimidin1yl)N(345trimethoxyphenyl)butanamide
892752704
CN1C(=O)C2=C(C=CS2)N3C1=NN=C3CCCC(=O)NC4=CC(=C(C(=C4)OC)OC)OC
InChI=1SC21H23N5O5Sc12520(28)1913(893219)2616(232421(25)26)65717(27)22121014(292)18(314)15(1112)303h811H57H214H3(H2227)
MFCD06743798
ZINC000008589585
ZINC08589585
ZINC8589585
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