Vitas-M small molecule compound
2-{[3-cyano-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(3,4-dimethylphenyl)acetamide
Catalog ID
STK839463
SMILES N#CC1=C(SCC(=O)Nc2ccc(c(c2)C)C)NC2=C(C1c1cccs1)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 C24H23N3O2S2 MW 449.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O2S2/c1-14-8-9-16(11-15(14)2)26-21(29)13-31-24-17(12-25)22(20-7-4-10-30-20)23-18(27-24)5-3-6-19(23)28/h4,7-11,22,27H,3,5-6,13H2,1-2H3,(H,26,29)InChIKey
OOBUGYQIYPIGKN-UHFFFAOYSA-NSynonyms
384359-21-12((3cyano5oxo4(thiophen2yl)145678hexahydroquinolin2yl)sulfanyl)N(34dimethylphenyl)acetamide
2((3cyano5oxo4(thiophen2yl)145678hexahydroquinolin2yl)thio)N(34dimethylphenyl)acetamide
2((3cyano5oxo4thiophen2yl4678tetrahydro1Hquinolin2yl)sulfanyl)N(34dimethylphenyl)acetamide
384359211
CC1=C(C=C(C=C1)NC(=O)CSC2=C(C(C3=C(N2)CCCC3=O)C4=CC=CS4)C#N)C
InChI=1SC24H23N3O2S2c1148916(1115(14)2)2621(29)13312417(1225)22(2074103020)2318(2724)53619(23)28h47112227H35613H212H3(H2629)
MFCD03001090
ZINC000013174515
ZINC000013174517
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