Vitas-M small molecule compound

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

Catalog ID
STK454850
SMILES CCOc1cc(ccc1OC(=O)C1CCCCC1)/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 C24H25NO5S MW 439.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25NO5S/c1-2-29-23-16-18(13-14-22(23)30-24(26)19-9-5-3-6-10-19)15-21(17-25)31(27,28)20-11-7-4-8-12-20/h4,7-8,11-16,19H,2-3,5-6,9-10H2,1H3/b21-15+
InChIKey
YLOLXWHFQLREBJ-RCCKNPSSSA-N
Synonyms

(4((E)2(BENZENESULFONYL)2CYANOETHENYL)2ETHOXYPHENYL)CYCLOHEXANECARBOXYLATE
4((1E)2CYANO2(PHENYLSULFONYL)VINYL)2ETHOXYPHENYLCYCLOHEXANECARBOXYLATE
4((E)2cyano2(phenylsulfonyl)ethenyl)2ethoxyphenylcyclohexanecarboxylate
CCOC1=C(C=CC(=C1)C=C(C#N)S(=O)(=O)C2=CC=CC=C2)OC(=O)C3CCCCC3
CCOc1cc(ccc1OC(=O)C1CCCCC1)C=C(S(=O)(=O)c1ccccc1)C#N
InChI=1SC24H25NO5Sc1229231618(131422(23)3024(26)1995361019)1521(1725)31(2728)20117481220h478111619H2356910H21H3b2115+
MFCD04137323
ZINC000002856823
ZINC02856823
ZINC2856823

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Available files

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