Vitas-M small molecule compound
2-(ethylsulfanyl)ethyl 4-(2,3-dimethoxyphenyl)-7-(2-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK403146
SMILES CCSCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1OC)OC)C(=O)CC(C2)c1ccccc1OC
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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/c1-6-38-15-14-37-30(33)26-18(2)31-22-16-19(20-10-7-8-12-24(20)34-3)17-23(32)28(22)27(26)21-11-9-13-25(35-4)29(21)36-5/h7-13,19,27,31H,6,14-17H2,1-5H3InChIKey
XPJHVXRCJCDNGK-UHFFFAOYSA-NSynonyms
2(ethylsulfanyl)ethyl4(23dimethoxyphenyl)7(2methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2ethylsulfanylethyl4(23dimethoxyphenyl)7(2methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CCSCCOC(=O)C1=C(NC2=C(C1C3=C(C(=CC=C3)OC)OC)C(=O)CC(C2)C4=CC=CC=C4OC)C
InChI=1SC30H35NO6Sc163815143730(33)2618(2)31221619(2010781224(20)343)1723(32)28(22)27(26)211191325(354)29(21)365h713192731H61417H215H3
MFCD03371109
ZINC000003639974
ZINC000003639992
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