Vitas-M small molecule compound
ethyl 6-amino-2-(chloromethyl)-5-cyano-4-(2,4-dichlorophenyl)-4H-pyran-3-carboxylate
Catalog ID
STK695730
SMILES CCOC(=O)C1=C(CCl)OC(=C(C1c1ccc(cc1Cl)Cl)C#N)N
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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 C16H13Cl3N2O3 MW 387.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13Cl3N2O3/c1-2-23-16(22)14-12(6-17)24-15(21)10(7-20)13(14)9-4-3-8(18)5-11(9)19/h3-5,13H,2,6,21H2,1H3InChIKey
PWHWQWCFCWQAPS-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(OC(=C(C1C2=C(C=C(C=C2)Cl)Cl)C#N)N)CCl
ethyl6amino2(chloromethyl)5cyano4(24dichlorophenyl)4Hpyran3carboxylate
InChI=1SC16H13Cl3N2O3c122316(22)1412(617)2415(21)10(720)13(14)9438(18)511(9)19h3513H2621H21H3
MFCD03033873
ZINC000001480500
ZINC000001480501
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