Vitas-M small molecule compound
diethyl 4-(2-ethoxyphenyl)-5-oxo-2-propyl-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK683550
SMILES CCOC(=O)C1C(=O)C2=C(CC1c1cccs1)NC(=C(C2c1ccccc1OCC)C(=O)OCC)CCC
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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 C30H35NO6S MW 537.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H35NO6S/c1-5-12-20-27(30(34)37-8-4)24(18-13-9-10-14-22(18)35-6-2)26-21(31-20)17-19(23-15-11-16-38-23)25(28(26)32)29(33)36-7-3/h9-11,13-16,19,24-25,31H,5-8,12,17H2,1-4H3InChIKey
OVSDUIFOXDCQMD-UHFFFAOYSA-NSynonyms
CCCC1=C(C(C2=C(N1)CC(C(C2=O)C(=O)OCC)C3=CC=CS3)C4=CC=CC=C4OCC)C(=O)OCC
diethyl4(2ethoxyphenyl)5oxo2propyl7(thiophen2yl)145678hexahydroquinoline36dicarboxylate
diethyl4(2ethoxyphenyl)5oxo2propyl7thiophen2yl4678tetrahydro1Hquinoline36dicarboxylate
InChI=1SC30H35NO6Sc15122027(30(34)3784)24(18139101422(18)3562)2621(3120)1719(231511163823)25(28(26)32)29(33)3673h911131619242531H581217H214H3
MFCD05258186
ZINC000100159336
ZINC000103011145
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