Vitas-M small molecule compound
2-({5-[3-(4-methoxy-3-methylphenyl)propyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4,5-trichlorophenyl)acetamide
Catalog ID
STK134657
SMILES COc1ccc(cc1C)CCCc1nnc(n1C)SCC(=O)Nc1cc(Cl)c(cc1Cl)Cl
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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 C22H23Cl3N4O2S MW 513.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23Cl3N4O2S/c1-13-9-14(7-8-19(13)31-3)5-4-6-20-27-28-22(29(20)2)32-12-21(30)26-18-11-16(24)15(23)10-17(18)25/h7-11H,4-6,12H2,1-3H3,(H,26,30)InChIKey
ACBNBKQUOKBKCW-UHFFFAOYSA-NSynonyms
2((5(3(4METHOXY3METHYLPHENYL)PROPYL)4METHYL124TRIAZOL3YL)SULFANYL)N(245TRICHLOROPHENYL)ACETAMIDE
2((5(3(4METHOXY3METHYLPHENYL)PROPYL)4METHYL4H124TRIAZOL3YL)SULFANYL)N(245TRICHLOROPHENYL)ACETAMIDE
CC1=C(C=CC(=C1)CCCC2=NN=C(N2C)SCC(=O)NC3=CC(=C(C=C3Cl)Cl)Cl)OC
InChI=1SC22H23Cl3N4O2Sc113914(7819(13)313)54620272822(29(20)2)321221(30)26181116(24)15(23)1017(18)25h711H4612H213H3(H2630)
MFCD04389257
ZINC000002858564
ZINC02858564
ZINC2858564
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