Vitas-M small molecule compound
2-{[4-(4-bromophenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(2,5-dimethoxyphenyl)ethanone
Catalog ID
STK554148
SMILES COc1ccc(c(c1)C(=O)CSc1nnc(n1c1ccc(cc1)Br)c1cccnc1)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 C23H19BrN4O3S MW 511.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19BrN4O3S/c1-30-18-9-10-21(31-2)19(12-18)20(29)14-32-23-27-26-22(15-4-3-11-25-13-15)28(23)17-7-5-16(24)6-8-17/h3-13H,14H2,1-2H3InChIKey
BNUCMDGYGZSARB-UHFFFAOYSA-NSynonyms
741691-73-61(25DIMETHOXYPHENYL)2(4(4BROMOPHENYL)5(3PYRIDYL)(124TRIAZOL3YLTHIO))ETHAN1ONE
2((4(4BROMOPHENYL)5(PYRIDIN3YL)4H124TRIAZOL3YL)SULFANYL)1(25DIMETHOXYPHENYL)ETHAN1ONE
2((4(4bromophenyl)5(pyridin3yl)4H124triazol3yl)sulfanyl)1(25dimethoxyphenyl)ethanone
2((4(4bromophenyl)5(pyridin3yl)4H124triazol3yl)thio)1(25dimethoxyphenyl)ethanone
2((4(4BROMOPHENYL)5PYRIDIN3YL124TRIAZOL3YL)SULFANYL)1(25DIMETHOXYPHENYL)ETHANONE
741691736
COC1=CC(=C(C=C1)OC)C(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Br)C4=CN=CC=C4
InChI=1SC23H19BrN4O3Sc1301891021(312)19(1218)20(29)143223272622(154311251315)28(23)177516(24)6817h313H14H212H3
MFCD03224901
ZINC000002260447
ZINC02260447
ZINC2260447
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