Vitas-M small molecule compound
(2E)-2-[(4-tert-butylphenyl)sulfonyl]-3-[(4-ethylphenyl)amino]-3-(methylsulfanyl)prop-2-enenitrile
Catalog ID
STL145767
SMILES CCc1ccc(cc1)N/C(=C(\S(=O)(=O)c1ccc(cc1)C(C)(C)C)/C#N)/SC
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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 C22H26N2O2S2 MW 414.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O2S2/c1-6-16-7-11-18(12-8-16)24-21(27-5)20(15-23)28(25,26)19-13-9-17(10-14-19)22(2,3)4/h7-14,24H,6H2,1-5H3/b21-20+InChIKey
QXQOPAABOLWWMY-QZQOTICOSA-NSynonyms
(2E)2((4tertbutylphenyl)sulfonyl)3((4ethylphenyl)amino)3(methylsulfanyl)prop2enenitrile
(E)2(4tertbutylphenyl)sulfonyl3(4ethylanilino)3methylsulfanylprop2enenitrile
CCC1=CC=C(C=C1)NC(=C(C#N)S(=O)(=O)C2=CC=C(C=C2)C(C)(C)C)SC
CCc1ccc(cc1)NC(=C(S(=O)(=O)c1ccc(cc1)C(C)(C)C)C#N)SC
InChI=1SC22H26N2O2S2c161671118(12816)2421(275)20(1523)28(2526)1913917(101419)22(23)4h71424H6H215H3b2120+
MFCD20755077
ZINC000071328719
ZINC71328719
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