Vitas-M small molecule compound
ethyl 4-({[3-(1,3-benzodioxol-5-ylmethyl)-1-(4-methoxyphenyl)-5-oxo-2-thioxoimidazolidin-4-yl]acetyl}amino)benzoate
Catalog ID
STK662833
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CC1C(=O)N(C(=S)N1Cc1ccc2c(c1)OCO2)c1ccc(cc1)OC
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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 C29H27N3O7S MW 561.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N3O7S/c1-3-37-28(35)19-5-7-20(8-6-19)30-26(33)15-23-27(34)32(21-9-11-22(36-2)12-10-21)29(40)31(23)16-18-4-13-24-25(14-18)39-17-38-24/h4-14,23H,3,15-17H2,1-2H3,(H,30,33)InChIKey
CHDBGQWFOSPJOP-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CC3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)OC
ethyl4(((3(13benzodioxol5ylmethyl)1(4methoxyphenyl)5oxo2thioxoimidazolidin4yl)acetyl)amino)benzoate
ETHYL4((2(3(13BENZODIOXOL5YLMETHYL)1(4METHOXYPHENYL)5OXO2SULFANYLIDENEIMIDAZOLIDIN4YL)ACETYL)AMINO)BENZOATE
ethyl4(2(3(benzo(d)(13)dioxol5ylmethyl)1(4methoxyphenyl)5oxo2thioxoimidazolidin4yl)acetamido)benzoate
InChI=1SC29H27N3O7Sc133728(35)195720(8619)3026(33)152327(34)32(2191122(362)121021)29(40)31(23)16184132425(1418)39173824h41423H31517H212H3(H3033)
MFCD03673500
ZINC000001077980
ZINC000098000128
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