Vitas-M small molecule compound

propyl 2-{[(3,4-diethoxyphenyl)acetyl]amino}-4-(4-methoxyphenyl)-5-methylthiophene-3-carboxylate

Catalog ID
STK450053
SMILES CCCOC(=O)c1c(NC(=O)Cc2ccc(c(c2)OCC)OCC)sc(c1c1ccc(cc1)OC)C

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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 C28H33NO6S MW 511.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33NO6S/c1-6-15-35-28(31)26-25(20-10-12-21(32-5)13-11-20)18(4)36-27(26)29-24(30)17-19-9-14-22(33-7-2)23(16-19)34-8-3/h9-14,16H,6-8,15,17H2,1-5H3,(H,29,30)
InChIKey
XSZLNDCZHQVFDH-UHFFFAOYSA-N
Synonyms

CCCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)OC)C)NC(=O)CC3=CC(=C(C=C3)OCC)OCC
InChI=1SC28H33NO6Sc16153528(31)2625(20101221(325)131120)18(4)3627(26)2924(30)171991422(3372)23(1619)3483h91416H681517H215H3(H2930)
MFCD03468311
PROPYL2(((34DIETHOXYPHENYL)ACETYL)AMINO)4(4METHOXYPHENYL)5METHYL3THIOPHENECARBOXYLATE
propyl2(((34diethoxyphenyl)acetyl)amino)4(4methoxyphenyl)5methylthiophene3carboxylate
PROPYL2((2(34DIETHOXYPHENYL)ACETYL)AMINO)4(4METHOXYPHENYL)5METHYLTHIOPHENE3CARBOXYLATE
PROPYL2(2(34DIETHOXYPHENYL)ACETYLAMINO)4(4METHOXYPHENYL)5METHYLTHIOPHENE3CARBOXYLATE
ZINC000008455287
ZINC08455287
ZINC8455287

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Available files

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