Vitas-M small molecule compound
ethyl 7-[4-(dimethylamino)phenyl]-2-methyl-4-(6-methyl-4-oxo-4H-chromen-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK406880
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1coc3c(c1=O)cc(cc3)C)C(=O)CC(C2)c1ccc(cc1)N(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 C31H32N2O5 MW 512.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32N2O5/c1-6-37-31(36)27-18(3)32-24-14-20(19-8-10-21(11-9-19)33(4)5)15-25(34)29(24)28(27)23-16-38-26-12-7-17(2)13-22(26)30(23)35/h7-13,16,20,28,32H,6,14-15H2,1-5H3InChIKey
YVTMKFZLGNUODL-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC2=C(C1C3=COC4=C(C3=O)C=C(C=C4)C)C(=O)CC(C2)C5=CC=C(C=C5)N(C)C)C
ethyl7(4(dimethylamino)phenyl)2methyl4(6methyl4oxo4Hchromen3yl)5oxo145678hexahydroquinoline3carboxylate
ethyl7(4(dimethylamino)phenyl)2methyl4(6methyl4oxochromen3yl)5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC31H32N2O5c163731(36)2718(3)32241420(1981021(11919)33(4)5)1525(34)29(24)28(27)2316382612717(2)1322(26)30(23)35h71316202832H61415H215H3
MFCD06000349
ZINC000001074844
ZINC000001074849
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