Vitas-M small molecule compound
N-benzyl-2-{[3-cyano-4-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}acetamide
Catalog ID
STK885684
SMILES N#CC1=C(SCC(=O)NCc2ccccc2)NC2=C(C1c1ccc(cc1)C)C(=O)CCC2
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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 C26H25N3O2S MW 443.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O2S/c1-17-10-12-19(13-11-17)24-20(14-27)26(29-21-8-5-9-22(30)25(21)24)32-16-23(31)28-15-18-6-3-2-4-7-18/h2-4,6-7,10-13,24,29H,5,8-9,15-16H2,1H3,(H,28,31)InChIKey
SWEJXQVJDBNCNQ-UHFFFAOYSA-NSynonyms
897833-50-0897833500
CC1=CC=C(C=C1)C2C(=C(NC3=C2C(=O)CCC3)SCC(=O)NCC4=CC=CC=C4)C#N
InChI=1SC26H25N3O2Sc117101219(131117)2420(1427)26(292185922(30)25(21)24)321623(31)2815186324718h246710132429H5891516H21H3(H2831)
MFCD07654834
Nbenzyl2((3cyano4(4methylphenyl)5oxo145678hexahydroquinolin2yl)sulfanyl)acetamide
Nbenzyl2((3cyano4(4methylphenyl)5oxo4678tetrahydro1Hquinolin2yl)sulfanyl)acetamide
ZINC000020347493
ZINC000020347495
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