Vitas-M small molecule compound

4-[(E)-2-cyano-2-(phenylsulfonyl)ethenyl]-2-ethoxyphenyl thiophene-2-carboxylate

Catalog ID
STK445262
SMILES CCOc1cc(ccc1OC(=O)c1cccs1)/C=C(/S(=O)(=O)c1ccccc1)\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 C22H17NO5S2 MW 439.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17NO5S2/c1-2-27-20-14-16(10-11-19(20)28-22(24)21-9-6-12-29-21)13-18(15-23)30(25,26)17-7-4-3-5-8-17/h3-14H,2H2,1H3/b18-13+
InChIKey
RSACUUBZQOLZNC-QGOAFFKASA-N
Synonyms

(4((E)2(BENZENESULFONYL)2CYANOETHENYL)2ETHOXYPHENYL)THIOPHENE2CARBOXYLATE
4((1E)2CYANO2(PHENYLSULFONYL)VINYL)2ETHOXYPHENYLTHIOPHENE2CARBOXYLATE
4((E)2cyano2(phenylsulfonyl)ethenyl)2ethoxyphenylthiophene2carboxylate
CCOC1=C(C=CC(=C1)C=C(C#N)S(=O)(=O)C2=CC=CC=C2)OC(=O)C3=CC=CS3
CCOc1cc(ccc1OC(=O)c1cccs1)C=C(S(=O)(=O)c1ccccc1)C#N
InChI=1SC22H17NO5S2c1227201416(101119(20)2822(24)2196122921)1318(1523)30(2526)177435817h314H2H21H3b1813+
MFCD04057673
ZINC000001121315
ZINC01121315
ZINC1121315

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Available files

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