Vitas-M small molecule compound

methyl 4-{(Z)-2-cyano-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]ethenyl}benzoate

Catalog ID
STK843816
SMILES N#C/C(=C/c1ccc(cc1)C(=O)OC)/c1scc(n1)c1ccc(c(c1)OC)OC

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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 C22H18N2O4S MW 406.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N2O4S/c1-26-19-9-8-16(11-20(19)27-2)18-13-29-21(24-18)17(12-23)10-14-4-6-15(7-5-14)22(25)28-3/h4-11,13H,1-3H3/b17-10-
InChIKey
HQMSDOMLOXYRIC-YVLHZVERSA-N
Synonyms
683250-07-9
(Z)methyl4(2cyano2(4(34dimethoxyphenyl)thiazol2yl)vinyl)benzoate
683250079
COC1=C(C=C(C=C1)C2=CSC(=N2)C(=CC3=CC=C(C=C3)C(=O)OC)C#N)OC
InChI=1SC22H18N2O4Sc126199816(1120(19)272)18132921(2418)17(1223)10144615(7514)22(25)283h41113H13H3b1710
methyl4((Z)2cyano2(4(34dimethoxyphenyl)13thiazol2yl)ethenyl)benzoate
MFCD03672782
N#CC(=Cc1ccc(cc1)C(=O)OC)c1scc(n1)c1ccc(c(c1)OC)OC
ZINC000013659523
ZINC13659523

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Available files

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