Vitas-M small molecule compound

ethyl 2-{[(2E)-2-cyano-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino}-4-(4-methoxyphenyl)thiophene-3-carboxylate

Catalog ID
STK739780
SMILES CCOC(=O)c1c(scc1c1ccc(cc1)OC)NC(=O)/C(=C/c1ccc(c(c1)OC)OC)/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 C26H24N2O6S MW 492.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O6S/c1-5-34-26(30)23-20(17-7-9-19(31-2)10-8-17)15-35-25(23)28-24(29)18(14-27)12-16-6-11-21(32-3)22(13-16)33-4/h6-13,15H,5H2,1-4H3,(H,28,29)/b18-12+
InChIKey
ISQNNUZPIXNZBZ-LDADJPATSA-N
Synonyms
327075-77-4
(E)ethyl2(2cyano3(34dimethoxyphenyl)acrylamido)4(4methoxyphenyl)thiophene3carboxylate
2((E)2CYANO3(34DIMETHOXYPHENYL)ACRYLOYLAMINO)4(4METHOXYPHENYL)THIOPHENE3CARBOXYLICACIDETHYLESTER
327075774
CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OC)NC(=O)C(=CC3=CC(=C(C=C3)OC)OC)C#N
CCOC(=O)c1c(scc1c1ccc(cc1)OC)NC(=O)C(=Cc1ccc(c(c1)OC)OC)C#N
ethyl2(((2E)2cyano3(34dimethoxyphenyl)prop2enoyl)amino)4(4methoxyphenyl)thiophene3carboxylate
ETHYL2(((E)2CYANO3(34DIMETHOXYPHENYL)PROP2ENOYL)AMINO)4(4METHOXYPHENYL)THIOPHENE3CARBOXYLATE
ETHYL2((2E)3(34DIMETHOXYPHENYL)2CYANOPROP2ENOYLAMINO)4(4METHOXYPHENYL)THIOPHENE3CARBOXYLATE
InChI=1SC26H24N2O6Sc153426(30)2320(177919(312)10817)153525(23)2824(29)18(1427)121661121(323)22(1316)334h61315H5H214H3(H2829)b1812+
MFCD01942352
ZINC000002276146
ZINC02276146
ZINC2276146

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.