Vitas-M small molecule compound
ethyl 4-({[3-({[2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropyl]carbonyl}amino)-1-benzofuran-2-yl]carbonyl}amino)benzoate
Catalog ID
STK913391
SMILES CCOC(=O)c1ccc(cc1)NC(=O)c1oc2c(c1NC(=O)C1C(C1(C)C)C=C(C)C)cccc2
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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 C28H30N2O5 MW 474.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2O5/c1-6-34-27(33)17-11-13-18(14-12-17)29-26(32)24-23(19-9-7-8-10-21(19)35-24)30-25(31)22-20(15-16(2)3)28(22,4)5/h7-15,20,22H,6H2,1-5H3,(H,29,32)(H,30,31)InChIKey
FXDIGEJTGZISFB-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3O2)NC(=O)C4C(C4(C)C)C=C(C)C
ethyl4(((3(((22dimethyl3(2methylprop1en1yl)cyclopropyl)carbonyl)amino)1benzofuran2yl)carbonyl)amino)benzoate
ethyl4((3((22dimethyl3(2methylprop1enyl)cyclopropanecarbonyl)amino)1benzofuran2carbonyl)amino)benzoate
InChI=1SC28H30N2O5c163427(33)17111318(141217)2926(32)2423(199781021(19)3524)3025(31)2220(1516(2)3)28(224)5h7152022H6H215H3(H2932)(H3031)
MFCD07428345
ZINC000012062580
ZINC000012062583
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