Vitas-M small molecule compound
(2Z)-3-{3-[(2,6-dimethylphenoxy)methyl]-4-methoxyphenyl}-2-(phenylsulfonyl)prop-2-enenitrile
Catalog ID
STK454920
SMILES COc1ccc(cc1COc1c(C)cccc1C)/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 C25H23NO4S MW 433.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23NO4S/c1-18-8-7-9-19(2)25(18)30-17-21-14-20(12-13-24(21)29-3)15-23(16-26)31(27,28)22-10-5-4-6-11-22/h4-15H,17H2,1-3H3/b23-15-InChIKey
JCZCMIPKAODQHM-HAHDFKILSA-NSynonyms
(2Z)3(3((26dimethylphenoxy)methyl)4methoxyphenyl)2(phenylsulfonyl)prop2enenitrile
(Z)2(BENZENESULFONYL)3(3((26DIMETHYLPHENOXY)METHYL)4METHOXYPHENYL)PROP2ENENITRILE
CC1=C(C(=CC=C1)C)OCC2=C(C=CC(=C2)C=C(C#N)S(=O)(=O)C3=CC=CC=C3)OC
COc1ccc(cc1COc1c(C)cccc1C)C=C(S(=O)(=O)c1ccccc1)C#N
InChI=1SC25H23NO4Sc11887919(2)25(18)3017211420(121324(21)293)1523(1626)31(2728)22105461122h415H17H213H3b2315
MFCD04220134
ZINC000032573665
ZINC32573665
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