Vitas-M small molecule compound
2-(propan-2-yloxy)ethyl 4-(2,3-dimethoxyphenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK403062
SMILES COc1cccc(c1OC)C1C(=C(C)NC2=C1C(=O)CC(C2)c1cccs1)C(=O)OCCOC(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 C28H33NO6S MW 511.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33NO6S/c1-16(2)34-11-12-35-28(31)24-17(3)29-20-14-18(23-10-7-13-36-23)15-21(30)26(20)25(24)19-8-6-9-22(32-4)27(19)33-5/h6-10,13,16,18,25,29H,11-12,14-15H2,1-5H3InChIKey
OOGRMUDKEPEHBO-UHFFFAOYSA-NSynonyms
2(propan2yloxy)ethyl4(23dimethoxyphenyl)2methyl5oxo7(thiophen2yl)145678hexahydroquinoline3carboxylate
2propan2yloxyethyl4(23dimethoxyphenyl)2methyl5oxo7thiophen2yl4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CS3)C4=C(C(=CC=C4)OC)OC)C(=O)OCCOC(C)C
InChI=1SC28H33NO6Sc116(2)3411123528(31)2417(3)29201418(23107133623)1521(30)26(20)25(24)1986922(324)27(19)335h6101316182529H11121415H215H3
MFCD03371066
ZINC000002727197
ZINC000002727200
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