Vitas-M small molecule compound
methyl (2Z)-5-benzyl-2-{[(1,3-dioxo-2-azaspiro[4.4]non-2-yl)acetyl]imino}-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL409758
SMILES COC(=O)c1[nH]/c(=N/C(=O)CN2C(=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 C22H23N3O5S MW 441.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O5S/c1-30-19(28)18-15(11-14-7-3-2-4-8-14)31-21(24-18)23-16(26)13-25-17(27)12-22(20(25)29)9-5-6-10-22/h2-4,7-8H,5-6,9-13H2,1H3,(H,23,24,26)InChIKey
GXZYBJIAUKMFII-UHFFFAOYSA-NSynonyms
1630869-99-61630869996
COC(=O)c1(nH)c(=NC(=O)CN2C(=O)CC3(C2=O)CCCC3)sc1Cc1ccccc1
COC(=O)C1=C(SC(=N1)NC(=O)CN2C(=O)CC3(C2=O)CCCC3)CC4=CC=CC=C4
InChI=1SC22H23N3O5Sc13019(28)1815(11147324814)3121(2418)2316(26)132517(27)1222(20(25)29)9561022h2478H56913H21H3(H232426)
methyl(2Z)5benzyl2(((13dioxo2azaspiro(44)non2yl)acetyl)imino)23dihydro13thiazole4carboxylate
methyl5benzyl2((2(13dioxo2azaspiro(44)nonan2yl)acetyl)amino)13thiazole4carboxylate
MFCD30705872
ZINC000170625104
ZINC170625104
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