Vitas-M small molecule compound

ethyl 2-{[(2E)-3-{5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl}-2-cyanoprop-2-enoyl]amino}-4,5-dimethylthiophene-3-carboxylate

Catalog ID
STL020976
SMILES CCOC(=O)c1c(NC(=O)/C(=C/c2ccc(o2)c2cc(ccc2Cl)C(F)(F)F)/C#N)sc(c1C)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 C24H18ClF3N2O4S MW 522.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18ClF3N2O4S/c1-4-33-23(32)20-12(2)13(3)35-22(20)30-21(31)14(11-29)9-16-6-8-19(34-16)17-10-15(24(26,27)28)5-7-18(17)25/h5-10H,4H2,1-3H3,(H,30,31)/b14-9+
InChIKey
WGOLLPNMKKFMTC-NTEUORMPSA-N
Synonyms
469877-02-9
(E)ethyl2(3(5(2chloro5(trifluoromethyl)phenyl)furan2yl)2cyanoacrylamido)45dimethylthiophene3carboxylate
469877029
CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C(=CC2=CC=C(O2)C3=C(C=CC(=C3)C(F)(F)F)Cl)C#N
CCOC(=O)c1c(NC(=O)C(=Cc2ccc(o2)c2cc(ccc2Cl)C(F)(F)F)C#N)sc(c1C)C
ethyl2(((2E)3(5(2chloro5(trifluoromethyl)phenyl)furan2yl)2cyanoprop2enoyl)amino)45dimethylthiophene3carboxylate
ETHYL2(((E)3(5(2CHLORO5(TRIFLUOROMETHYL)PHENYL)FURAN2YL)2CYANOPROP2ENOYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
ETHYL2((2E)3(5(2CHLORO5(TRIFLUOROMETHYL)PHENYL)(2FURYL))2CYANOPROP2ENOYLAMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
InChI=1SC24H18ClF3N2O4Sc143323(32)2012(2)13(3)3522(20)3021(31)14(1129)9166819(3416)171015(24(2627)28)5718(17)25h510H4H213H3(H3031)b149+
MFCD02371046
ZINC000001805811
ZINC1805811

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Available files

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