Vitas-M small molecule compound

methyl [(5Z)-3-methyl-4-oxo-2-thioxo-5-(2,4,5-trimethoxybenzylidene)imidazolidin-1-yl]acetate

Catalog ID
STL369436
SMILES COC(=O)CN1C(=S)N(C(=O)/C/1=C/c1cc(OC)c(cc1OC)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 C17H20N2O6S MW 380.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O6S/c1-18-16(21)11(19(17(18)26)9-15(20)25-5)6-10-7-13(23-3)14(24-4)8-12(10)22-2/h6-8H,9H2,1-5H3/b11-6-
InChIKey
FVZQDPYSRJBWHO-WDZFZDKYSA-N
Synonyms

CN1C(=O)C(=CC2=CC(=C(C=C2OC)OC)OC)N(C1=S)CC(=O)OC
COC(=O)CN1C(=S)N(C(=O)C1=Cc1cc(OC)c(cc1OC)OC)C
InChI=1SC17H20N2O6Sc11816(21)11(19(17(18)26)915(20)255)610713(233)14(244)812(10)222h68H9H215H3b116
methyl((5Z)3methyl4oxo2thioxo5(245trimethoxybenzylidene)imidazolidin1yl)acetate
METHYL2((5Z)3METHYL4OXO2SULFANYLIDENE5((245TRIMETHOXYPHENYL)METHYLIDENE)IMIDAZOLIDIN1YL)ACETATE
MFCD03721484
ZINC000001131672
ZINC01131672
ZINC1131672

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.