Vitas-M small molecule compound
3-[5-({2-[(2,3-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]-N-(4-fluorophenyl)propanamide
Catalog ID
STK231280
SMILES CCn1c(CCC(=O)Nc2ccc(cc2)F)nnc1SCC(=O)Nc1cccc(c1C)C
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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 C23H26FN5O2S MW 455.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26FN5O2S/c1-4-29-20(12-13-21(30)25-18-10-8-17(24)9-11-18)27-28-23(29)32-14-22(31)26-19-7-5-6-15(2)16(19)3/h5-11H,4,12-14H2,1-3H3,(H,25,30)(H,26,31)InChIKey
GJYSDMRUFTXTDV-UHFFFAOYSA-NSynonyms
3(5((2((23dimethylphenyl)amino)2oxoethyl)sulfanyl)4ethyl4H124triazol3yl)N(4fluorophenyl)propanamide
3(5(2(23DIMETHYLANILINO)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)N(4FLUOROPHENYL)PROPANAMIDE
CCN1C(=NN=C1SCC(=O)NC2=CC=CC(=C2C)C)CCC(=O)NC3=CC=C(C=C3)F
InChI=1SC23H26FN5O2Sc142920(121321(30)251810817(24)91118)272823(29)321422(31)261975615(2)16(19)3h511H41214H213H3(H2530)(H2631)
MFCD07358919
ZINC000009304304
ZINC09304304
ZINC9304304
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