Vitas-M small molecule compound
(5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-(3-ethoxy-4-propoxybenzylidene)-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK590269
SMILES CCCOc1ccc(cc1OCC)/C=C/1\C(=O)N(C2CCS(=O)(=O)C2)C(=O)C(=C1C)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 C23H26N2O6S MW 458.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2O6S/c1-4-9-31-20-7-6-16(12-21(20)30-5-2)11-18-15(3)19(13-24)23(27)25(22(18)26)17-8-10-32(28,29)14-17/h6-7,11-12,17H,4-5,8-10,14H2,1-3H3/b18-11-InChIKey
HICHDIKBANDETI-WQRHYEAKSA-NSynonyms
(5Z)1(11dioxidotetrahydrothiophen3yl)5(3ethoxy4propoxybenzylidene)4methyl26dioxo1256tetrahydropyridine3carbonitrile
(5Z)1(11DIOXOTHIOLAN3YL)5((3ETHOXY4PROPOXYPHENYL)METHYLIDENE)4METHYL26DIOXOPYRIDINE3CARBONITRILE
(Z)1(11dioxidotetrahydrothiophen3yl)5(3ethoxy4propoxybenzylidene)4methyl26dioxo1256tetrahydropyridine3carbonitrile
CCCOC1=C(C=C(C=C1)C=C2C(=C(C(=O)N(C2=O)C3CCS(=O)(=O)C3)C#N)C)OCC
CCCOc1ccc(cc1OCC)C=C1C(=O)N(C2CCS(=O)(=O)C2)C(=O)C(=C1C)C#N
InChI=1SC23H26N2O6Sc14931207616(1221(20)3052)111815(3)19(1324)23(27)25(22(18)26)1781032(2829)1417h67111217H4581014H213H3b1811
MFCD05696426
ZINC000009291815
ZINC000013810901
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