Vitas-M small molecule compound
(2E)-2-[(2,5-dimethylphenyl)sulfonyl]-3-(methylsulfanyl)-3-(piperidin-1-yl)prop-2-enenitrile
Catalog ID
STK880446
SMILES CS/C(=C(/S(=O)(=O)c1cc(C)ccc1C)\C#N)/N1CCCCC1
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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 C17H22N2O2S2 MW 350.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O2S2/c1-13-7-8-14(2)15(11-13)23(20,21)16(12-18)17(22-3)19-9-5-4-6-10-19/h7-8,11H,4-6,9-10H2,1-3H3/b17-16+InChIKey
HWRINOBYZHPHDC-WUKNDPDISA-NSynonyms
1113111-16-2(2E)2((25dimethylphenyl)sulfonyl)3(methylsulfanyl)3(piperidin1yl)prop2enenitrile
(E)2(25DIMETHYLBENZENESULFONYL)3METHYLSULFANYL3PIPERIDIN1YLACRYLONITRILE
(E)2(25dimethylphenyl)sulfonyl3methylsulfanyl3piperidin1ylprop2enenitrile
1113111162
CC1=CC(=C(C=C1)C)S(=O)(=O)C(=C(N2CCCCC2)SC)C#N
CSC(=C(S(=O)(=O)c1cc(C)ccc1C)C#N)N1CCCCC1
InChI=1SC17H22N2O2S2c1137814(2)15(1113)23(2021)16(1218)17(223)1995461019h7811H46910H213H3b1716+
MFCD14703626
ZINC000040478943
ZINC40478943
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