Vitas-M small molecule compound
{4-bromo-2-[(Z)-(5-oxo-1-propyl-2-thioxoimidazolidin-4-ylidene)methyl]phenoxy}acetic acid
Catalog ID
STL375209
SMILES CCCN1C(=S)N/C(=C\c2cc(Br)ccc2OCC(=O)O)/C1=O
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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 C15H15BrN2O4S MW 399.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15BrN2O4S/c1-2-5-18-14(21)11(17-15(18)23)7-9-6-10(16)3-4-12(9)22-8-13(19)20/h3-4,6-7H,2,5,8H2,1H3,(H,17,23)(H,19,20)/b11-7-InChIKey
OHVXGFMIVDGXMU-XFFZJAGNSA-NSynonyms
(4bromo2((Z)(5oxo1propyl2thioxoimidazolidin4ylidene)methyl)phenoxy)aceticacid
2(4BROMO2((Z)(5OXO1PROPYL2SULFANYLIDENEIMIDAZOLIDIN4YLIDENE)METHYL)PHENOXY)ACETICACID
CCCN1C(=O)C(=CC2=C(C=CC(=C2)Br)OCC(=O)O)NC1=S
CCCN1C(=S)NC(=Cc2cc(Br)ccc2OCC(=O)O)C1=O
InChI=1SC15H15BrN2O4Sc1251814(21)11(1715(18)23)79610(16)3412(9)22813(19)20h3467H258H21H3(H1723)(H1920)b117
MFCD04086816
ZINC000003662893
ZINC3662893
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