Vitas-M small molecule compound
tert-butyl 6-amino-5-cyano-4-(2,4-dichlorophenyl)-2-methyl-4H-pyran-3-carboxylate
Catalog ID
STK759962
SMILES N#CC1=C(N)OC(=C(C1c1ccc(cc1Cl)Cl)C(=O)OC(C)(C)C)C
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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 C18H18Cl2N2O3 MW 381.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18Cl2N2O3/c1-9-14(17(23)25-18(2,3)4)15(12(8-21)16(22)24-9)11-6-5-10(19)7-13(11)20/h5-7,15H,22H2,1-4H3InChIKey
XTWGNLCDAUYBOS-UHFFFAOYSA-NSynonyms
CC1=C(C(C(=C(O1)N)C#N)C2=C(C=C(C=C2)Cl)Cl)C(=O)OC(C)(C)C
InChI=1SC18H18Cl2N2O3c1914(17(23)2518(23)4)15(12(821)16(22)249)116510(19)713(11)20h5715H22H214H3
MFCD01571592
tertbutyl6amino5cyano4(24dichlorophenyl)2methyl4Hpyran3carboxylate
ZINC000000708403
ZINC000000708404
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