Vitas-M small molecule compound
2-(ethylsulfanyl)ethyl 4-[4-(benzyloxy)-3-methoxyphenyl]-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK002944
SMILES CCSCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)OCc1ccccc1)C(=O)CC(C2)c1ccccc1
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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 C35H37NO5S MW 583.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H37NO5S/c1-4-42-18-17-40-35(38)32-23(2)36-28-19-27(25-13-9-6-10-14-25)20-29(37)34(28)33(32)26-15-16-30(31(21-26)39-3)41-22-24-11-7-5-8-12-24/h5-16,21,27,33,36H,4,17-20,22H2,1-3H3InChIKey
VQAMBHNCYNEJJJ-UHFFFAOYSA-NSynonyms
2(ethylsulfanyl)ethyl4(4(benzyloxy)3methoxyphenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
2ethylsulfanylethyl4(3methoxy4phenylmethoxyphenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
CCSCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)OCc1ccccc1)C(=O)CC(C2)c1ccccc1
CCSCCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)C(=O)CC(C2)C5=CC=CC=C5)C
InChI=1SC35H37NO5Sc144218174035(38)3223(2)36281927(251396101425)2029(37)34(28)33(32)26151630(31(2126)393)412224117581224h51621273336H4172022H213H3
MFCD01528049
STK002944
ZINC000002758146
ZINC000002758149
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