Vitas-M small molecule compound
methyl 2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-5-ethylthiophene-3-carboxylate
Catalog ID
STL019260
SMILES COC(=O)c1cc(sc1N1C(=O)C2C(C1=O)C1CC2C=C1)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 C17H17NO4S MW 331.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO4S/c1-3-10-7-11(17(21)22-2)16(23-10)18-14(19)12-8-4-5-9(6-8)13(12)15(18)20/h4-5,7-9,12-13H,3,6H2,1-2H3InChIKey
CYHGZIVWKOOGOU-UHFFFAOYSA-NSynonyms
1005107-97-01005107970
CCC1=CC(=C(S1)N2C(=O)C3C4CC(C3C2=O)C=C4)C(=O)OC
InChI=1SC17H17NO4Sc1310711(17(21)222)16(2310)1814(19)128459(68)13(12)15(18)20h45791213H36H212H3
methyl2(13dioxo133a477ahexahydro2H47methanoisoindol2yl)5ethylthiophene3carboxylate
METHYL2(13DIOXO3A477ATETRAHYDRO1H47METHANOISOINDOL2(3H)YL)5ETHYLTHIOPHENE3CARBOXYLATE
MFCD05743643
ZINC000100903024
ZINC000101756400
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.