Vitas-M small molecule compound

(2E)-3-[(3,5-dichlorophenyl)amino]-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile

Catalog ID
STK833631
SMILES N#C/C(=C\Nc1cc(Cl)cc(c1)Cl)/c1scc(n1)c1cc2ccccc2oc1=O

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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 C21H11Cl2N3O2S MW 440.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H11Cl2N3O2S/c22-14-6-15(23)8-16(7-14)25-10-13(9-24)20-26-18(11-29-20)17-5-12-3-1-2-4-19(12)28-21(17)27/h1-8,10-11,25H/b13-10+
InChIKey
ZDWRXLYVRZWQIU-JLHYYAGUSA-N
Synonyms

(2E)3((35dichlorophenyl)amino)2(4(2oxo2Hchromen3yl)13thiazol2yl)prop2enenitrile
(E)3((35dichlorophenyl)amino)2(4(2oxo2Hchromen3yl)thiazol2yl)acrylonitrile
(E)3(35DICHLOROANILINO)2(4(2OXOCHROMEN3YL)13THIAZOL2YL)PROP2ENENITRILE
C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CSC(=N3)C(=CNC4=CC(=CC(=C4)Cl)Cl)C#N
InChI=1SC21H11Cl2N3O2Sc2214615(23)816(714)251013(924)202618(112920)17512312419(12)2821(17)27h18101125Hb1310+
MFCD01958621
N#CC(=CNc1cc(Cl)cc(c1)Cl)c1scc(n1)c1cc2ccccc2oc1=O
ZINC000015659486
ZINC15659486

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Available files

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