Vitas-M small molecule compound
N-(4-bromo-2,6-dimethylphenyl)-2-{[4-(4-methoxyphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL354087
SMILES COc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cc(cc2C)Br)nnc1c1ccncc1
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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 C24H22BrN5O2S MW 524.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22BrN5O2S/c1-15-12-18(25)13-16(2)22(15)27-21(31)14-33-24-29-28-23(17-8-10-26-11-9-17)30(24)19-4-6-20(32-3)7-5-19/h4-13H,14H2,1-3H3,(H,27,31)InChIKey
WBJNQRGTHXZNJT-UHFFFAOYSA-NSynonyms
CC1=CC(=CC(=C1NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)C4=CC=NC=C4)C)Br
InChI=1SC24H22BrN5O2Sc1151218(25)1316(2)22(15)2721(31)143324292823(178102611917)30(24)194620(323)7519h413H14H213H3(H2731)
MFCD03997911
N(4bromo26dimethylphenyl)2((4(4methoxyphenyl)5(pyridin4yl)4H124triazol3yl)sulfanyl)acetamide
N(4BROMO26DIMETHYLPHENYL)2((4(4METHOXYPHENYL)5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000002838244
ZINC2838244
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