Vitas-M small molecule compound
ethyl 4-[({[5-(4-butoxyphenyl)-2,2-dimethyl-2H-imidazol-4-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL143867
SMILES CCCCOc1ccc(cc1)C1=NC(N=C1SCC(=O)Nc1ccc(cc1)C(=O)OCC)(C)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 C26H31N3O4S MW 481.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N3O4S/c1-5-7-16-33-21-14-10-18(11-15-21)23-24(29-26(3,4)28-23)34-17-22(30)27-20-12-8-19(9-13-20)25(31)32-6-2/h8-15H,5-7,16-17H2,1-4H3,(H,27,30)InChIKey
STTKOVHUFNHFHF-UHFFFAOYSA-NSynonyms
CCCCOC1=CC=C(C=C1)C2=NC(N=C2SCC(=O)NC3=CC=C(C=C3)C(=O)OCC)(C)C
ethyl4((((5(4butoxyphenyl)22dimethyl2Himidazol4yl)sulfanyl)acetyl)amino)benzoate
ethyl4((2(5(4butoxyphenyl)22dimethylimidazol4yl)sulfanylacetyl)amino)benzoate
InChI=1SC26H31N3O4Sc157163321141018(111521)2324(2926(34)2823)341722(30)272012819(91320)25(31)3262h815H571617H214H3(H2730)
MFCD20750190
ZINC000071328016
ZINC71328016
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