Vitas-M small molecule compound

(2E)-3-{[2-(2-chloro-1,1,2-trifluoroethoxy)phenyl]amino}-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile

Catalog ID
STK535330
SMILES COc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccccc1OC(C(Cl)F)(F)F)/C#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 C21H15ClF3N3O2S MW 465.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15ClF3N3O2S/c1-29-15-8-6-13(7-9-15)17-12-31-19(28-17)14(10-26)11-27-16-4-2-3-5-18(16)30-21(24,25)20(22)23/h2-9,11-12,20,27H,1H3/b14-11+
InChIKey
ZRHUUWYVJSZNHF-SDNWHVSQSA-N
Synonyms

(2E)3((2(2chloro112trifluoroethoxy)phenyl)amino)2(4(4methoxyphenyl)13thiazol2yl)prop2enenitrile
(E)3((2(2chloro112trifluoroethoxy)phenyl)amino)2(4(4methoxyphenyl)thiazol2yl)acrylonitrile
(E)3(2(2CHLORO112TRIFLUOROETHOXY)ANILINO)2(4(4METHOXYPHENYL)13THIAZOL2YL)PROP2ENENITRILE
COC1=CC=C(C=C1)C2=CSC(=N2)C(=CNC3=CC=CC=C3OC(C(F)Cl)(F)F)C#N
COc1ccc(cc1)c1csc(n1)C(=CNc1ccccc1OC(C(Cl)F)(F)F)C#N
InChI=1SC21H15ClF3N3O2Sc129158613(7915)17123119(2817)14(1026)112716423518(16)3021(2425)20(22)23h2911122027H1H3b1411+
MFCD02982469
ZINC000002284825
ZINC000002284827

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Available files

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