Vitas-M small molecule compound
N-(3-bromophenyl)-2-{[5-(7-methoxy-1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK218951
SMILES COc1cccc2c1oc(c2)c1nnc(n1C)SCC(=O)Nc1cccc(c1)Br
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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 C20H17BrN4O3S MW 473.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17BrN4O3S/c1-25-19(16-9-12-5-3-8-15(27-2)18(12)28-16)23-24-20(25)29-11-17(26)22-14-7-4-6-13(21)10-14/h3-10H,11H2,1-2H3,(H,22,26)InChIKey
QKMRPUGGVGPGNB-UHFFFAOYSA-NSynonyms
CN1C(=NN=C1SCC(=O)NC2=CC(=CC=C2)Br)C3=CC4=C(O3)C(=CC=C4)OC
InChI=1SC20H17BrN4O3Sc12519(1691253815(272)18(12)2816)232420(25)291117(26)221474613(21)1014h310H11H212H3(H2226)
MFCD06000446
N(3BROMOPHENYL)2((5(7METHOXY1BENZOFURAN2YL)4METHYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(3BROMOPHENYL)2((5(7METHOXY1BENZOFURAN2YL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000001075102
ZINC01075102
ZINC1075102
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