Vitas-M small molecule compound
3-ethyl-1-(2-{6-[(E)-(hydroxyimino)methyl]-7-methoxy-1,3-benzodioxol-5-yl}ethyl)-1-methylthiourea
Catalog ID
STL520670
SMILES CCNC(=S)N(CCc1cc2OCOc2c(c1/C=N/O)OC)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 C15H21N3O4S MW 339.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H21N3O4S/c1-4-16-15(23)18(2)6-5-10-7-12-14(22-9-21-12)13(20-3)11(10)8-17-19/h7-8,19H,4-6,9H2,1-3H3,(H,16,23)/b17-8+InChIKey
PVFPKXMYEYMFNK-CAOOACKPSA-NSynonyms
858767-30-3(E)3ethyl1(2(6((hydroxyimino)methyl)7methoxybenzo(d)(13)dioxol5yl)ethyl)1methylthiourea
3ethyl1(2(6((~(E))hydroxyiminomethyl)7methoxy13benzodioxol5yl)ethyl)1methylthiourea
3ethyl1(2(6((E)(hydroxyimino)methyl)7methoxy13benzodioxol5yl)ethyl)1methylthiourea
3ETHYL1(2(6((E)HYDROXYIMINOMETHYL)7METHOXY13BENZODIOXOL5YL)ETHYL)1METHYLTHIOUREA
6874700
858767303
CCNC(=S)N(CCc1cc2OCOc2c(c1C=NO)OC)C
InChI=1SC15H21N3O4Sc141615(23)18(2)651071214(2292112)13(203)11(10)81719h7819H469H213H3(H1623)b178+
MFCD04145043
ZINC000100756786
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