Vitas-M small molecule compound

methyl 4-(1H-indol-5-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK653136
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccc3c(c1)cc[nH]3)C(=O)CC(C2)(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 C22H24N2O3 MW 364.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O3/c1-12-18(21(26)27-4)19(14-5-6-15-13(9-14)7-8-23-15)20-16(24-12)10-22(2,3)11-17(20)25/h5-9,19,23-24H,10-11H2,1-4H3
InChIKey
AUNQZGLDAICRJL-UHFFFAOYSA-N
Synonyms
1144487-34-2
1144487342
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC4=C(C=C3)NC=C4)C(=O)OC
COC(=O)C1=C(C)NC2=C(C1c1ccc3c(c1)cc(nH)3)C(=O)CC(C2)(C)C
InChI=1SC22H24N2O3c11218(21(26)274)19(14561513(914)782315)2016(2412)1022(23)1117(20)25h59192324H1011H214H3
methyl4(1Hindol5yl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
methyl4(1Hindol5yl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
MFCD12214507
ZINC000032093739
ZINC000032093741

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Available files

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