Vitas-M small molecule compound

dimethyl 2-({(E)-2-cyano-2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzene-1,4-dicarboxylate

Catalog ID
STK537528
SMILES N#C/C(=C\Nc1cc(ccc1C(=O)OC)C(=O)OC)/c1scc(n1)c1ccc(c(c1)Cl)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 C22H15Cl2N3O4S MW 488.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15Cl2N3O4S/c1-30-21(28)13-3-5-15(22(29)31-2)18(8-13)26-10-14(9-25)20-27-19(11-32-20)12-4-6-16(23)17(24)7-12/h3-8,10-11,26H,1-2H3/b14-10+
InChIKey
XLPKVWCPRDQSHD-GXDHUFHOSA-N
Synonyms

(E)dimethyl2((2cyano2(4(34dichlorophenyl)thiazol2yl)vinyl)amino)terephthalate
COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC=C(C#N)C2=NC(=CS2)C3=CC(=C(C=C3)Cl)Cl
dimethyl2(((E)2cyano2(4(34dichlorophenyl)13thiazol2yl)ethenyl)amino)benzene14dicarboxylate
InChI=1SC22H15Cl2N3O4Sc13021(28)133515(22(29)312)18(813)261014(925)202719(113220)124616(23)17(24)712h38101126H12H3b1410+
MFCD02982892
N#CC(=CNc1cc(ccc1C(=O)OC)C(=O)OC)c1scc(n1)c1ccc(c(c1)Cl)Cl
ZINC000001830574
ZINC01830574
ZINC1830574

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Available files

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