Vitas-M small molecule compound
{4-bromo-2-[(Z)-(1-ethyl-5-oxo-2-thioxoimidazolidin-4-ylidene)methyl]phenoxy}acetic acid
Catalog ID
STL378727
SMILES CCN1C(=O)/C(=C/c2cc(Br)ccc2OCC(=O)O)/NC1=S
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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 C14H13BrN2O4S MW 385.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13BrN2O4S/c1-2-17-13(20)10(16-14(17)22)6-8-5-9(15)3-4-11(8)21-7-12(18)19/h3-6H,2,7H2,1H3,(H,16,22)(H,18,19)/b10-6-InChIKey
QCWIQROHKCOXKY-POHAHGRESA-NSynonyms
675166-98-0(4bromo2((Z)(1ethyl5oxo2thioxoimidazolidin4ylidene)methyl)phenoxy)aceticacid
2(4BROMO2((Z)(1ETHYL5OXO2SULFANYLIDENEIMIDAZOLIDIN4YLIDENE)METHYL)PHENOXY)ACETICACID
675166980
CCN1C(=O)C(=CC2=C(C=CC(=C2)Br)OCC(=O)O)NC1=S
CCN1C(=O)C(=Cc2cc(Br)ccc2OCC(=O)O)NC1=S
InChI=1SC14H13BrN2O4Sc121713(20)10(1614(17)22)6859(15)3411(8)21712(18)19h36H27H21H3(H1622)(H1819)b106
MFCD03711981
ZINC000001163192
ZINC1163192
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