Vitas-M small molecule compound
N-(2,6-dimethylphenyl)-2-{[4-(4-ethoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK074376
SMILES CCOc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cccc2C)nnc1c1cccnc1
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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 C25H25N5O2S MW 459.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5O2S/c1-4-32-21-12-10-20(11-13-21)30-24(19-9-6-14-26-15-19)28-29-25(30)33-16-22(31)27-23-17(2)7-5-8-18(23)3/h5-15H,4,16H2,1-3H3,(H,27,31)InChIKey
BMNITXLTWIZRFI-UHFFFAOYSA-NSynonyms
499125-76-7499125767
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C=CC=C3C)C)C4=CN=CC=C4
CCOc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cccc2C)nnc1c1cccnc1
InChI=1SC25H25N5O2Sc143221121020(111321)3024(199614261519)282925(30)331622(31)272317(2)75818(23)3h515H416H213H3(H2731)
MFCD03225173
N(26DIMETHYLPHENYL)2((4(4ETHOXYPHENYL)5(PYRIDIN3YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(26dimethylphenyl)2((4(4ethoxyphenyl)5(pyridin3yl)4H124triazol3yl)thio)acetamide
N(26DIMETHYLPHENYL)2((4(4ETHOXYPHENYL)5PYRIDIN3YL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(26DIMETHYLPHENYL)2(4(4ETHOXYPHENYL)5(3PYRIDYL)(124TRIAZOL3YLTHIO))ACETAMIDE
STK074376
ZINC000001240432
ZINC01240432
ZINC1240432
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.