Vitas-M small molecule compound
methyl (2E)-5-benzyl-2-{[3-(1,3-dioxo-2-azaspiro[4.4]non-2-yl)propanoyl]imino}-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL409831
SMILES COC(=O)c1[nH]/c(=N\C(=O)CCN2C(=O)CC3(C2=O)CCCC3)/sc1Cc1ccccc1
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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 C23H25N3O5S MW 455.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O5S/c1-31-20(29)19-16(13-15-7-3-2-4-8-15)32-22(25-19)24-17(27)9-12-26-18(28)14-23(21(26)30)10-5-6-11-23/h2-4,7-8H,5-6,9-14H2,1H3,(H,24,25,27)InChIKey
HIHFXRMYQXUVPK-UHFFFAOYSA-NSynonyms
1574301-56-61574301566
COC(=O)c1(nH)c(=NC(=O)CCN2C(=O)CC3(C2=O)CCCC3)sc1Cc1ccccc1
COC(=O)C1=C(SC(=N1)NC(=O)CCN2C(=O)CC3(C2=O)CCCC3)CC4=CC=CC=C4
InChI=1SC23H25N3O5Sc13120(29)1916(13157324815)3222(2519)2417(27)9122618(28)1423(21(26)30)10561123h2478H56914H21H3(H242527)
methyl(2E)5benzyl2((3(13dioxo2azaspiro(44)non2yl)propanoyl)imino)23dihydro13thiazole4carboxylate
methyl5benzyl2(3(13dioxo2azaspiro(44)nonan2yl)propanoylamino)13thiazole4carboxylate
MFCD30705908
ZINC000096224190
ZINC96224190
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