Vitas-M small molecule compound
ethyl 7-(furan-2-yl)-2,5-dioxo-4-(thiophen-3-yl)-1,2,3,4,5,6,7,8-octahydroquinoline-6-carboxylate
Catalog ID
STK686791
SMILES CCOC(=O)C1C(CC2=C(C1=O)C(CC(=O)N2)c1ccsc1)c1ccco1
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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 C20H19NO5S MW 385.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19NO5S/c1-2-25-20(24)18-13(15-4-3-6-26-15)8-14-17(19(18)23)12(9-16(22)21-14)11-5-7-27-10-11/h3-7,10,12-13,18H,2,8-9H2,1H3,(H,21,22)InChIKey
XQRURRVDYROTDP-UHFFFAOYSA-NSynonyms
CCOC(=O)C1C(CC2=C(C1=O)C(CC(=O)N2)C3=CSC=C3)C4=CC=CO4
ethyl7(furan2yl)25dioxo4(thiophen3yl)12345678octahydroquinoline6carboxylate
ethyl7(furan2yl)25dioxo4thiophen3yl134678hexahydroquinoline6carboxylate
InChI=1SC20H19NO5Sc122520(24)1813(154362615)81417(19(18)23)12(916(22)2114)1157271011h3710121318H289H21H3(H2122)
MFCD06017593
ZINC000004742178
ZINC000014944768
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