Vitas-M small molecule compound
2-{[4-(3-bromophenyl)-3-cyano-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(3-chloro-2-methylphenyl)acetamide
Catalog ID
STK841653
SMILES N#CC1=C(SCC(=O)Nc2cccc(c2C)Cl)NC(=O)CC1c1cccc(c1)Br
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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 C21H17BrClN3O2S MW 490.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17BrClN3O2S/c1-12-17(23)6-3-7-18(12)25-20(28)11-29-21-16(10-24)15(9-19(27)26-21)13-4-2-5-14(22)8-13/h2-8,15H,9,11H2,1H3,(H,25,28)(H,26,27)InChIKey
QQMLQEXPFLNTGW-UHFFFAOYSA-NSynonyms
488706-23-62((4(3bromophenyl)3cyano6oxo1456tetrahydropyridin2yl)sulfanyl)N(3chloro2methylphenyl)acetamide
2((4(3bromophenyl)3cyano6oxo1456tetrahydropyridin2yl)thio)N(3chloro2methylphenyl)acetamide
2((4(3BROMOPHENYL)5CYANO2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)N(3CHLORO2METHYLPHENYL)ACETAMIDE
488706236
CC1=C(C=CC=C1Cl)NC(=O)CSC2=C(C(CC(=O)N2)C3=CC(=CC=C3)Br)C#N
InChI=1SC21H17BrClN3O2Sc11217(23)63718(12)2520(28)11292116(1024)15(919(27)2621)1342514(22)813h2815H911H21H3(H2528)(H2627)
MFCD03290510
ZINC000009088674
ZINC000009088675
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