Vitas-M small molecule compound
methyl (2E)-5-benzyl-2-{[(2,2-dimethyl-5-oxotetrahydrofuran-3-yl)carbonyl]imino}-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL408407
SMILES COC(=O)c1[nH]/c(=N\C(=O)C2CC(=O)OC2(C)C)/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 C19H20N2O5S MW 388.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O5S/c1-19(2)12(10-14(22)26-19)16(23)21-18-20-15(17(24)25-3)13(27-18)9-11-7-5-4-6-8-11/h4-8,12H,9-10H2,1-3H3,(H,20,21,23)InChIKey
XIIQXOCNONZITR-UHFFFAOYSA-NSynonyms
1574253-05-61574253056
CC1(C(CC(=O)O1)C(=O)NC2=NC(=C(S2)CC3=CC=CC=C3)C(=O)OC)C
COC(=O)c1(nH)c(=NC(=O)C2CC(=O)OC2(C)C)sc1Cc1ccccc1
InChI=1SC19H20N2O5Sc119(2)12(1014(22)2619)16(23)21182015(17(24)253)13(2718)9117546811h4812H910H213H3(H202123)
methyl(2E)5benzyl2(((22dimethyl5oxotetrahydrofuran3yl)carbonyl)imino)23dihydro13thiazole4carboxylate
methyl5benzyl2((22dimethyl5oxooxolane3carbonyl)amino)13thiazole4carboxylate
MFCD30705212
ZINC000096116963
ZINC000096116964
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