Vitas-M small molecule compound
{2-chloro-4-[(1Z)-2-cyano-3-oxo-3-(propan-2-ylamino)prop-1-en-1-yl]-6-ethoxyphenoxy}acetic acid
Catalog ID
STK379933
SMILES CCOc1cc(/C=C(\C(=O)NC(C)C)/C#N)cc(c1OCC(=O)O)Cl
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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 C17H19ClN2O5 MW 366.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19ClN2O5/c1-4-24-14-7-11(5-12(8-19)17(23)20-10(2)3)6-13(18)16(14)25-9-15(21)22/h5-7,10H,4,9H2,1-3H3,(H,20,23)(H,21,22)/b12-5-InChIKey
YDZWOPVBMLFZEB-XGICHPGQSA-NSynonyms
(2chloro4((1Z)2cyano3oxo3(propan2ylamino)prop1en1yl)6ethoxyphenoxy)aceticacid
2(2CHLORO4((Z)2CYANO3OXO3(PROPAN2YLAMINO)PROP1ENYL)6ETHOXYPHENOXY)ACETICACID
2(4((1Z)2CYANO2(N(METHYLETHYL)CARBAMOYL)VINYL)2CHLORO6ETHOXYPHENOXY)ACETICACID
CCOC1=C(C(=CC(=C1)C=C(C#N)C(=O)NC(C)C)Cl)OCC(=O)O
CCOc1cc(C=C(C(=O)NC(C)C)C#N)cc(c1OCC(=O)O)Cl
InChI=1SC17H19ClN2O5c142414711(512(819)17(23)2010(2)3)613(18)16(14)25915(21)22h5710H49H213H3(H2023)(H2122)b125
MFCD02105187
ZINC000004506817
ZINC4506817
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