Vitas-M small molecule compound
2-(4-chlorophenoxy)-2-methyl-N-[2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]propanamide
Catalog ID
STK520067
SMILES Clc1ccc(cc1)OC(C(=O)Nc1cc(ccc1C)c1nn2c(s1)nnc2C)(C)C
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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 C21H20ClN5O2S MW 441.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClN5O2S/c1-12-5-6-14(18-26-27-13(2)24-25-20(27)30-18)11-17(12)23-19(28)21(3,4)29-16-9-7-15(22)8-10-16/h5-11H,1-4H3,(H,23,28)InChIKey
NMKLDMGAUALVRJ-UHFFFAOYSA-NSynonyms
2(4chlorophenoxy)2methylN(2methyl5(3methyl(124)triazolo(34b)(134)thiadiazol6yl)phenyl)propanamide
CC1=C(C=C(C=C1)C2=NN3C(=NN=C3S2)C)NC(=O)C(C)(C)OC4=CC=C(C=C4)Cl
InChI=1SC21H20ClN5O2Sc1125614(18262713(2)242520(27)3018)1117(12)2319(28)21(34)29169715(22)81016h511H14H3(H2328)
MFCD08121638
ZINC000008832405
ZINC08832405
ZINC8832405
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