Vitas-M small molecule compound
(2S,3R)-methyl 2-(3-(benzo[d][1,3]dioxol-5-ylmethyl)ureido)-3-methylpentanoate
Catalog ID
STL533089
SMILES CCC([C@@H](C(=O)OC)NC(=O)NCc1ccc2c(c1)OCO2)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 C16H22N2O5 MW 322.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2O5/c1-4-10(2)14(15(19)21-3)18-16(20)17-8-11-5-6-12-13(7-11)23-9-22-12/h5-7,10,14H,4,8-9H2,1-3H3,(H2,17,18,20)/t10?,14-/m0/s1InChIKey
FQUZRVYVEYLLHM-SBNLOKMTSA-NSynonyms
956942-42-0(2S3R)methyl2(3(benzo(d)(13)dioxol5ylmethyl)ureido)3methylpentanoate
16399742
956942420
CCC((C@@H)(C(=O)OC)NC(=O)NCc1ccc2c(c1)OCO2)C
InChI=1SC16H22N2O5c1410(2)14(15(19)213)1816(20)17811561213(711)2392212h571014H489H213H3(H2171820)t10?14m0s1
methyl(2~(S))2(13benzodioxol5ylmethylcarbamoylamino)3methylpentanoate
ZINC000002157780
ZINC000012860447
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