Vitas-M small molecule compound
methyl (2Z)-2-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylacetyl)imino]-5-phenyl-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL252133
SMILES COC(=O)c1[nH]/c(=N/C(=O)Cc2ccc3c(c2)OCCCO3)/sc1c1ccccc1
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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 C22H20N2O5S MW 424.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O5S/c1-27-21(26)19-20(15-6-3-2-4-7-15)30-22(24-19)23-18(25)13-14-8-9-16-17(12-14)29-11-5-10-28-16/h2-4,6-9,12H,5,10-11,13H2,1H3,(H,23,24,25)InChIKey
IWSDFAJQQWCOQJ-UHFFFAOYSA-NSynonyms
1374541-47-51374541475
COC(=O)c1(nH)c(=NC(=O)Cc2ccc3c(c2)OCCCO3)sc1c1ccccc1
methyl(2Z)2((34dihydro2H15benzodioxepin7ylacetyl)imino)5phenyl23dihydro13thiazole4carboxylate
MFCD24852882
ZINC000072406221
ZINC72406221
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