Vitas-M small molecule compound
2-(propan-2-yloxy)ethyl 7-(3-methoxyphenyl)-2-methyl-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK403439
SMILES COc1cccc(c1)C1CC(=O)C2=C(C1)NC(=C(C2c1cccs1)C(=O)OCCOC(C)C)C
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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 C27H31NO5S MW 481.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31NO5S/c1-16(2)32-10-11-33-27(30)24-17(3)28-21-14-19(18-7-5-8-20(13-18)31-4)15-22(29)25(21)26(24)23-9-6-12-34-23/h5-9,12-13,16,19,26,28H,10-11,14-15H2,1-4H3InChIKey
KFLWWSXXKLGDLL-UHFFFAOYSA-NSynonyms
2(propan2yloxy)ethyl7(3methoxyphenyl)2methyl5oxo4(thiophen2yl)145678hexahydroquinoline3carboxylate
2propan2yloxyethyl7(3methoxyphenyl)2methyl5oxo4thiophen2yl4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC(=CC=C3)OC)C4=CC=CS4)C(=O)OCCOC(C)C
InChI=1SC27H31NO5Sc116(2)3210113327(30)2417(3)28211419(1875820(1318)314)1522(29)25(21)26(24)2396123423h59121316192628H10111415H214H3
MFCD03489274
ZINC000002758852
ZINC000002758855
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