Vitas-M small molecule compound

methyl 2-{[1-(4-ethylphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}benzoate

Catalog ID
STL020692
SMILES COC(=O)c1ccccc1SC1CC(=O)N(C1=O)c1ccc(cc1)CC

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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 C20H19NO4S MW 369.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19NO4S/c1-3-13-8-10-14(11-9-13)21-18(22)12-17(19(21)23)26-16-7-5-4-6-15(16)20(24)25-2/h4-11,17H,3,12H2,1-2H3
InChIKey
LLKHZTGTVHWFKM-UHFFFAOYSA-N
Synonyms
857494-40-7
857494407
CCC1=CC=C(C=C1)N2C(=O)CC(C2=O)SC3=CC=CC=C3C(=O)OC
InChI=1SC20H19NO4Sc131381014(11913)2118(22)1217(19(21)23)2616754615(16)20(24)252h41117H312H212H3
methyl2((1(4ethylphenyl)25dioxopyrrolidin3yl)sulfanyl)benzoate
METHYL2((1(4ETHYLPHENYL)25DIOXOPYRROLIDIN3YL)THIO)BENZOATE
METHYL2(1(4ETHYLPHENYL)25DIOXOAZOLIDIN3YLTHIO)BENZOATE
methyl2(1(4ethylphenyl)25dioxopyrrolidin3yl)sulfanylbenzoate
MFCD07189792
ZINC000005016474
ZINC000101129794

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.