Vitas-M small molecule compound

2-benzyl 4-ethyl 5-({(Z)-2-cyano-2-[4-(thiophen-2-yl)-1,3-thiazol-2-yl]ethenyl}amino)-3-methylthiophene-2,4-dicarboxylate

Catalog ID
STK803925
SMILES CCOC(=O)c1c(N/C=C(\c2scc(n2)c2cccs2)/C#N)sc(c1C)C(=O)OCc1ccccc1

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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 C26H21N3O4S3 MW 535.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N3O4S3/c1-3-32-25(30)21-16(2)22(26(31)33-14-17-8-5-4-6-9-17)36-24(21)28-13-18(12-27)23-29-19(15-35-23)20-10-7-11-34-20/h4-11,13,15,28H,3,14H2,1-2H3/b18-13-
InChIKey
DJKVPGNKVCERBA-AQTBWJFISA-N
Synonyms
578699-90-8
(Z)2benzyl4ethyl5((2cyano2(4(thiophen2yl)thiazol2yl)vinyl)amino)3methylthiophene24dicarboxylate
2benzyl4ethyl5(((Z)2cyano2(4(thiophen2yl)13thiazol2yl)ethenyl)amino)3methylthiophene24dicarboxylate
2OBENZYL4OETHYL5(((Z)2CYANO2(4THIOPHEN2YL13THIAZOL2YL)ETHENYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
578699908
CCOC(=O)C1=C(SC(=C1C)C(=O)OCC2=CC=CC=C2)NC=C(C#N)C3=NC(=CS3)C4=CC=CS4
CCOC(=O)c1c(NC=C(c2scc(n2)c2cccs2)C#N)sc(c1C)C(=O)OCc1ccccc1
InChI=1SC26H21N3O4S3c133225(30)2116(2)22(26(31)3314178546917)3624(21)281318(1227)232919(153523)20107113420h411131528H314H212H3b1813
MFCD04029240
ZINC000002386876
ZINC2386876

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Available files

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