Vitas-M small molecule compound
{2-chloro-4-[(Z)-(5-oxo-1-propyl-2-thioxoimidazolidin-4-ylidene)methyl]phenoxy}acetic acid
Catalog ID
STL417287
SMILES CCCN1C(=S)N/C(=C\c2ccc(c(c2)Cl)OCC(=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 C15H15ClN2O4S MW 354.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15ClN2O4S/c1-2-5-18-14(21)11(17-15(18)23)7-9-3-4-12(10(16)6-9)22-8-13(19)20/h3-4,6-7H,2,5,8H2,1H3,(H,17,23)(H,19,20)/b11-7-InChIKey
VUVBGGGSZWSCAD-XFFZJAGNSA-NSynonyms
(2chloro4((Z)(5oxo1propyl2thioxoimidazolidin4ylidene)methyl)phenoxy)aceticacid
2(2chloro4((Z)(5oxo1propyl2sulfanylideneimidazolidin4ylidene)methyl)phenoxy)aceticacid
CCCN1C(=O)C(=CC2=CC(=C(C=C2)OCC(=O)O)Cl)NC1=S
CCCN1C(=S)NC(=Cc2ccc(c(c2)Cl)OCC(=O)O)C1=O
InChI=1SC15H15ClN2O4Sc1251814(21)11(1715(18)23)793412(10(16)69)22813(19)20h3467H258H21H3(H1723)(H1920)b117
MFCD14710841
ZINC000003662901
ZINC3662901
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