Vitas-M small molecule compound
methyl (2Z)-2-{[(2,2-dimethyl-5-oxotetrahydrofuran-3-yl)carbonyl]imino}-5-phenyl-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL410360
SMILES COC(=O)c1[nH]/c(=N/C(=O)C2CC(=O)OC2(C)C)/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 C18H18N2O5S MW 374.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O5S/c1-18(2)11(9-12(21)25-18)15(22)20-17-19-13(16(23)24-3)14(26-17)10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,19,20,22)InChIKey
YLOHZZUVHVCHST-UHFFFAOYSA-NSynonyms
1574252-33-71574252337
CC1(C(CC(=O)O1)C(=O)NC2=NC(=C(S2)C3=CC=CC=C3)C(=O)OC)C
COC(=O)c1(nH)c(=NC(=O)C2CC(=O)OC2(C)C)sc1c1ccccc1
InChI=1SC18H18N2O5Sc118(2)11(912(21)2518)15(22)20171913(16(23)243)14(2617)107546810h4811H9H213H3(H192022)
methyl(2Z)2(((22dimethyl5oxotetrahydrofuran3yl)carbonyl)imino)5phenyl23dihydro13thiazole4carboxylate
methyl2((22dimethyl5oxooxolane3carbonyl)amino)5phenyl13thiazole4carboxylate
MFCD30706163
ZINC000096118386
ZINC000096118387
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