Vitas-M small molecule compound
1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl N-(1,3-benzodioxol-5-ylmethyl)-N'-(4-ethoxyphenyl)carbamimidothioate
Catalog ID
STK675672
SMILES CCOc1ccc(cc1)/N=C(\SC1CC(=O)N(C1=O)c1ccc(cc1)OCC)/NCc1ccc2c(c1)OCO2
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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 C29H29N3O6S MW 547.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N3O6S/c1-3-35-22-10-6-20(7-11-22)31-29(30-17-19-5-14-24-25(15-19)38-18-37-24)39-26-16-27(33)32(28(26)34)21-8-12-23(13-9-21)36-4-2/h5-15,26H,3-4,16-18H2,1-2H3,(H,30,31)InChIKey
MYVJHZSNQHDWSO-UHFFFAOYSA-NSynonyms
(1(4ETHOXYPHENYL)25DIOXOPYRROLIDIN3YL)N(13BENZODIOXOL5YLMETHYL)N(4ETHOXYPHENYL)CARBAMIMIDOTHIOATE
1(4ETHOXYPHENYL)25DIOXO3PYRROLIDINYLN(13BENZODIOXOL5YLMETHYL)N(4ETHOXYPHENYL)IMIDOTHIOCARBAMATE
1(4ethoxyphenyl)25dioxopyrrolidin3ylN(13benzodioxol5ylmethyl)N(4ethoxyphenyl)carbamimidothioate
CCOC1=CC=C(C=C1)NC(=NCC2=CC3=C(C=C2)OCO3)SC4CC(=O)N(C4=O)C5=CC=C(C=C5)OCC
CCOc1ccc(cc1)N=C(SC1CC(=O)N(C1=O)c1ccc(cc1)OCC)NCc1ccc2c(c1)OCO2
InChI=1SC29H29N3O6Sc13352210620(71122)3129(3017195142425(1519)38183724)39261627(33)32(28(26)34)2181223(13921)3642h51526H341618H212H3(H3031)
MFCD01820022
ZINC000000708462
ZINC000008690313
Check stock
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Check stock on Vitas-MAvailable files
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