Vitas-M small molecule compound
2-{[6-(3-bromophenyl)pyridazin-3-yl]sulfanyl}-1-(3,4-dimethoxyphenyl)ethanone
Catalog ID
STL074238
SMILES COc1cc(ccc1OC)C(=O)CSc1ccc(nn1)c1cccc(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 C20H17BrN2O3S MW 445.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17BrN2O3S/c1-25-18-8-6-14(11-19(18)26-2)17(24)12-27-20-9-7-16(22-23-20)13-4-3-5-15(21)10-13/h3-11H,12H2,1-2H3InChIKey
SMFRLXRAWOXAIY-UHFFFAOYSA-NSynonyms
2((6(3bromophenyl)pyridazin3yl)sulfanyl)1(34dimethoxyphenyl)ethanone
2(6(3bromophenyl)pyridazin3yl)sulfanyl1(34dimethoxyphenyl)ethanone
COC1=C(C=C(C=C1)C(=O)CSC2=NN=C(C=C2)C3=CC(=CC=C3)Br)OC
InChI=1SC20H17BrN2O3Sc125188614(1119(18)262)17(24)1227209716(222320)1343515(21)1013h311H12H212H3
MFCD18195632
ZINC000057486359
ZINC57486359
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