Vitas-M small molecule compound
(5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-4-methyl-2,6-dioxo-5-[(quinolin-5-ylamino)methylidene]-1,2,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK619310
SMILES N#CC1=C(C)/C(=C/Nc2cccc3c2cccn3)/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 C21H18N4O4S MW 422.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O4S/c1-13-16(10-22)20(26)25(14-7-9-30(28,29)12-14)21(27)17(13)11-24-19-6-2-5-18-15(19)4-3-8-23-18/h2-6,8,11,14,24H,7,9,12H2,1H3/b17-11-InChIKey
UWNHJIROFDEEIS-BOPFTXTBSA-NSynonyms
(5Z)1(11dioxidotetrahydrothiophen3yl)4methyl26dioxo5((quinolin5ylamino)methylidene)1256tetrahydropyridine3carbonitrile
(5Z)1(11dioxothiolan3yl)4methyl26dioxo5((quinolin5ylamino)methylidene)pyridine3carbonitrile
(Z)1(11dioxidotetrahydrothiophen3yl)4methyl26dioxo5((quinolin5ylamino)methylene)1256tetrahydropyridine3carbonitrile
CC1=C(C(=O)N(C(=O)C1=CNC2=CC=CC3=C2C=CC=N3)C4CCS(=O)(=O)C4)C#N
InChI=1SC21H18N4O4Sc11316(1022)20(26)25(147930(2829)1214)21(27)17(13)1124196251815(19)4382318h268111424H7912H21H3b1711
MFCD09798593
N#CC1=C(C)C(=CNc2cccc3c2cccn3)C(=O)N(C1=O)C1CCS(=O)(=O)C1
ZINC000008993377
ZINC000008993378
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