Vitas-M small molecule compound
N-(3,5-dimethoxyphenyl)-4-(4-methyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)butanamide
Catalog ID
STL135075
SMILES COc1cc(NC(=O)CCCc2nnc3n2c2ccsc2c(=O)n3C)cc(c1)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 C20H21N5O4S MW 427.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O4S/c1-24-19(27)18-15(7-8-30-18)25-16(22-23-20(24)25)5-4-6-17(26)21-12-9-13(28-2)11-14(10-12)29-3/h7-11H,4-6H2,1-3H3,(H,21,26)InChIKey
BWOOOHJFYCJMEK-UHFFFAOYSA-NSynonyms
CN1C(=O)C2=C(C=CS2)N3C1=NN=C3CCCC(=O)NC4=CC(=CC(=C4)OC)OC
InChI=1SC20H21N5O4Sc12419(27)1815(783018)2516(222320(24)25)54617(26)2112913(282)1114(1012)293h711H46H213H3(H2126)
MFCD14902127
N(35dimethoxyphenyl)4(4methyl5oxo45dihydrothieno(23e)(124)triazolo(43a)pyrimidin1yl)butanamide
ZINC000009431281
ZINC9431281
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