Vitas-M small molecule compound
2-{[3-cyano-4-(4-hydroxy-3-methoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Catalog ID
STK553429
SMILES N#CC1=C(SCC(=O)Nc2ccc(cc2)C)NC2=C(C1c1ccc(c(c1)OC)O)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 C26H25N3O4S MW 475.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O4S/c1-15-6-9-17(10-7-15)28-23(32)14-34-26-18(13-27)24(16-8-11-20(30)22(12-16)33-2)25-19(29-26)4-3-5-21(25)31/h6-12,24,29-30H,3-5,14H2,1-2H3,(H,28,32)InChIKey
ZCKLUZZHSZFVNN-UHFFFAOYSA-NSynonyms
799776-31-12((3cyano4(4hydroxy3methoxyphenyl)5oxo145678hexahydroquinolin2yl)sulfanyl)N(4methylphenyl)acetamide
2((3cyano4(4hydroxy3methoxyphenyl)5oxo145678hexahydroquinolin2yl)thio)N(ptolyl)acetamide
2((3cyano4(4hydroxy3methoxyphenyl)5oxo4678tetrahydro1Hquinolin2yl)sulfanyl)N(4methylphenyl)acetamide
799776311
CC1=CC=C(C=C1)NC(=O)CSC2=C(C(C3=C(N2)CCCC3=O)C4=CC(=C(C=C4)O)OC)C#N
InChI=1SC26H25N3O4Sc1156917(10715)2823(32)14342618(1327)24(1681120(30)22(1216)332)2519(2926)43521(25)31h612242930H3514H212H3(H2832)
MFCD03672806
ZINC000013189398
ZINC000013189400
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