Vitas-M small molecule compound

methyl 5-benzyl-2-{[(3-ethyl-5-methyl-1,2-oxazol-4-yl)carbonyl]amino}thiophene-3-carboxylate

Catalog ID
STK485241
SMILES COC(=O)c1cc(sc1NC(=O)c1c(C)onc1CC)Cc1ccccc1

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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 C20H20N2O4S MW 384.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O4S/c1-4-16-17(12(2)26-22-16)18(23)21-19-15(20(24)25-3)11-14(27-19)10-13-8-6-5-7-9-13/h5-9,11H,4,10H2,1-3H3,(H,21,23)
InChIKey
WFVHJDXMOVOYKZ-UHFFFAOYSA-N
Synonyms

CCC1=NOC(=C1C(=O)NC2=C(C=C(S2)CC3=CC=CC=C3)C(=O)OC)C
InChI=1SC20H20N2O4Sc141617(12(2)262216)18(23)211915(20(24)253)1114(2719)10138657913h5911H410H213H3(H2123)
METHYL2((3ETHYL5METHYLISOXAZOL4YL)CARBONYLAMINO)5BENZYLTHIOPHENE3CARBOXYLATE
methyl5benzyl2(((3ethyl5methyl12oxazol4yl)carbonyl)amino)thiophene3carboxylate
methyl5benzyl2((3ethyl5methyl12oxazole4carbonyl)amino)thiophene3carboxylate
MFCD08724499
ZINC000013327074
ZINC13327074

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Available files

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