Vitas-M small molecule compound
1-(4-methoxy-2,5-dimethylphenyl)-2-{[4-(2-methylpropyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK506322
SMILES COc1cc(C)c(cc1C)C(=O)CSc1nnc(n1CC(C)C)c1cccnc1
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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 C22H26N4O2S MW 410.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O2S/c1-14(2)12-26-21(17-7-6-8-23-11-17)24-25-22(26)29-13-19(27)18-9-16(4)20(28-5)10-15(18)3/h6-11,14H,12-13H2,1-5H3InChIKey
AGHTUJKDLQKABE-UHFFFAOYSA-NSynonyms
1(4methoxy25dimethylphenyl)2((4(2methylpropyl)5(pyridin3yl)4H124triazol3yl)sulfanyl)ethanone
1(4methoxy25dimethylphenyl)2((4(2methylpropyl)5pyridin3yl124triazol3yl)sulfanyl)ethanone
CC1=CC(=C(C=C1C(=O)CSC2=NN=C(N2CC(C)C)C3=CN=CC=C3)C)OC
InChI=1SC22H26N4O2Sc114(2)122621(17768231117)242522(26)291319(27)18916(4)20(285)1015(18)3h61114H1213H215H3
MFCD13368936
ZINC000009226045
ZINC09226045
ZINC9226045
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