Vitas-M small molecule compound

(2Z)-3-[3,4-bis(benzyloxy)phenyl]-2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile

Catalog ID
STK551749
SMILES COc1cccc(c1)c1csc(n1)/C(=C\c1ccc(c(c1)OCc1ccccc1)OCc1ccccc1)/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 C33H26N2O3S MW 530.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H26N2O3S/c1-36-29-14-8-13-27(19-29)30-23-39-33(35-30)28(20-34)17-26-15-16-31(37-21-24-9-4-2-5-10-24)32(18-26)38-22-25-11-6-3-7-12-25/h2-19,23H,21-22H2,1H3/b28-17-
InChIKey
HHYJBGJZTJBILD-QRQIAZFYSA-N
Synonyms
476673-17-3
(2Z)3(34bis(benzyloxy)phenyl)2(4(3methoxyphenyl)13thiazol2yl)prop2enenitrile
(Z)3(34bis(benzyloxy)phenyl)2(4(3methoxyphenyl)thiazol2yl)acrylonitrile
(Z)3(34bis(phenylmethoxy)phenyl)2(4(3methoxyphenyl)13thiazol2yl)prop2enenitrile
476673173
COC1=CC=CC(=C1)C2=CSC(=N2)C(=CC3=CC(=C(C=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)C#N
COc1cccc(c1)c1csc(n1)C(=Cc1ccc(c(c1)OCc1ccccc1)OCc1ccccc1)C#N
InChI=1SC33H26N2O3Sc136291481327(1929)30233933(3530)28(2034)1726151631(37212494251024)32(1826)382225116371225h21923H2122H21H3b2817
MFCD03672247
ZINC000100947104
ZINC100947104

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Available files

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