Vitas-M small molecule compound
methyl 4-(2,5-dimethoxyphenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK007650
SMILES COc1ccc(c(c1)C1C(=C(C)NC2=C1C(=O)CC(C2)c1cccs1)C(=O)OC)OC
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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 C24H25NO5S MW 439.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25NO5S/c1-13-21(24(27)30-4)22(16-12-15(28-2)7-8-19(16)29-3)23-17(25-13)10-14(11-18(23)26)20-6-5-9-31-20/h5-9,12,14,22,25H,10-11H2,1-4H3InChIKey
XBEFAEHXEPAAHX-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CS3)C4=C(C=CC(=C4)OC)OC)C(=O)OC
COc1ccc(c(c1)C1C(=C(C)NC2=C1C(=O)CC(C2)c1cccs1)C(=O)OC)OC
InChI=1SC24H25NO5Sc11321(24(27)304)22(161215(282)7819(16)293)2317(2513)1014(1118(23)26)206593120h5912142225H1011H214H3
methyl4(25dimethoxyphenyl)2methyl5oxo7(thiophen2yl)145678hexahydroquinoline3carboxylate
methyl4(25dimethoxyphenyl)2methyl5oxo7thiophen2yl4678tetrahydro1Hquinoline3carboxylate
MFCD02188164
STK007650
ZINC000019629808
ZINC000019629819
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