Vitas-M small molecule compound

(2E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile

Catalog ID
STK537452
SMILES CCc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc2c(c1)OCCO2)/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 C22H19N3O2S MW 389.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O2S/c1-2-15-3-5-16(6-4-15)19-14-28-22(25-19)17(12-23)13-24-18-7-8-20-21(11-18)27-10-9-26-20/h3-8,11,13-14,24H,2,9-10H2,1H3/b17-13+
InChIKey
ZZNRAPKRMHIAIM-GHRIWEEISA-N
Synonyms

(2E)3(23dihydro14benzodioxin6ylamino)2(4(4ethylphenyl)13thiazol2yl)prop2enenitrile
(E)3((23dihydrobenzo(b)(14)dioxin6yl)amino)2(4(4ethylphenyl)thiazol2yl)acrylonitrile
(E)3(23DIHYDRO14BENZODIOXIN6YLAMINO)2(4(4ETHYLPHENYL)13THIAZOL2YL)PROP2ENENITRILE
(E)3(23DIHYDROBENZO(14)DIOXIN6YLAMINO)2(4(4ETHYLPHENYL)THIAZOL2YL)ACRYLONITRILE
CCC1=CC=C(C=C1)C2=CSC(=N2)C(=CNC3=CC4=C(C=C3)OCCO4)C#N
CCc1ccc(cc1)c1csc(n1)C(=CNc1ccc2c(c1)OCCO2)C#N
InChI=1SC22H19N3O2Sc12153516(6415)19142822(2519)17(1223)132418782021(1118)271092620h3811131424H2910H21H3b1713+
MFCD02983565
ZINC000002307715
ZINC02307715
ZINC2307715

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Available files

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