Vitas-M small molecule compound
(5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{[(2-methoxyphenyl)amino]methylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK991761
SMILES N#CC1=C(C)/C(=C/Nc2ccccc2OC)/C(=O)N(C1=O)C1CCS(=O)(=O)C1
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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 C19H19N3O5S MW 401.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O5S/c1-12-14(9-20)18(23)22(13-7-8-28(25,26)11-13)19(24)15(12)10-21-16-5-3-4-6-17(16)27-2/h3-6,10,13,21H,7-8,11H2,1-2H3/b15-10-InChIKey
DUYFXLRYCSZJSB-GDNBJRDFSA-NSynonyms
(5Z)1(11dioxidotetrahydrothiophen3yl)5(((2methoxyphenyl)amino)methylidene)4methyl26dioxo1256tetrahydropyridine3carbonitrile
(5Z)1(11dioxothiolan3yl)5((2methoxyanilino)methylidene)4methyl26dioxopyridine3carbonitrile
(Z)1(11dioxidotetrahydrothiophen3yl)5(((2methoxyphenyl)amino)methylene)4methyl26dioxo1256tetrahydropyridine3carbonitrile
CC1=C(C(=O)N(C(=O)C1=CNC2=CC=CC=C2OC)C3CCS(=O)(=O)C3)C#N
InChI=1SC19H19N3O5Sc11214(920)18(23)22(137828(2526)1113)19(24)15(12)102116534617(16)272h36101321H7811H212H3b1510
MFCD09848703
N#CC1=C(C)C(=CNc2ccccc2OC)C(=O)N(C1=O)C1CCS(=O)(=O)C1
ZINC000008993102
ZINC000008993103
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