Vitas-M small molecule compound

2-ethyl 4-methyl 5-(4,6-dioxo-2-phenyl-3-{4-[(phenylcarbonyl)oxy]phenyl}hexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl)-3-methylthiophene-2,4-dicarboxylate

Catalog ID
STL148813
SMILES CCOC(=O)c1sc(c(c1C)C(=O)OC)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccc(cc1)OC(=O)c1ccccc1

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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 C34H28N2O9S MW 640.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H28N2O9S/c1-4-43-34(41)28-19(2)24(33(40)42-3)31(46-28)35-29(37)25-26(36(45-27(25)30(35)38)22-13-9-6-10-14-22)20-15-17-23(18-16-20)44-32(39)21-11-7-5-8-12-21/h5-18,25-27H,4H2,1-3H3
InChIKey
MVJZENSCQPGAAN-UHFFFAOYSA-N
Synonyms

2ethyl4methyl5(3(4(benzoyloxy)phenyl)46dioxo2phenyltetrahydro2Hpyrrolo(34d)isoxazol5(3H)yl)3methylthiophene24dicarboxylate
2ethyl4methyl5(46dioxo2phenyl3(4((phenylcarbonyl)oxy)phenyl)hexahydro5Hpyrrolo(34d)(12)oxazol5yl)3methylthiophene24dicarboxylate
2OETHYL4OMETHYL5(3(4BENZOYLOXYPHENYL)46DIOXO2PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL5YL)3METHYLTHIOPHENE24DICARBOXYLATE
CCOC(=O)C1=C(C(=C(S1)N2C(=O)C3C(N(OC3C2=O)C4=CC=CC=C4)C5=CC=C(C=C5)OC(=O)C6=CC=CC=C6)C(=O)OC)C
InChI=1SC34H28N2O9Sc144334(41)2819(2)24(33(40)423)31(4628)3529(37)2526(36(4527(25)30(35)38)221396101422)20151723(181620)4432(39)21117581221h5182527H4H213H3
MFCD04074854
ZINC000150661364
ZINC000245246494

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Available files

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