Vitas-M small molecule compound

diethyl 4-[4-(dimethylamino)phenyl]-5-oxo-2-propyl-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate

Catalog ID
STK683672
SMILES CCOC(=O)C1=C(CCC)NC2=C(C1c1ccc(cc1)N(C)C)C(=O)C(C(C2)c1cccs1)C(=O)OCC

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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 C30H36N2O5S MW 536.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H36N2O5S/c1-6-10-21-27(30(35)37-8-3)24(18-12-14-19(15-13-18)32(4)5)26-22(31-21)17-20(23-11-9-16-38-23)25(28(26)33)29(34)36-7-2/h9,11-16,20,24-25,31H,6-8,10,17H2,1-5H3
InChIKey
AVSMAZUAQICSRL-UHFFFAOYSA-N
Synonyms

CCCC1=C(C(C2=C(N1)CC(C(C2=O)C(=O)OCC)C3=CC=CS3)C4=CC=C(C=C4)N(C)C)C(=O)OCC
diethyl4(4(dimethylamino)phenyl)5oxo2propyl7(thiophen2yl)145678hexahydroquinoline36dicarboxylate
diethyl4(4(dimethylamino)phenyl)5oxo2propyl7thiophen2yl4678tetrahydro1Hquinoline36dicarboxylate
InChI=1SC30H36N2O5Sc16102127(30(35)3783)24(18121419(151318)32(4)5)2622(3121)1720(23119163823)25(28(26)33)29(34)3672h9111620242531H681017H215H3
MFCD05258523
ZINC000001423005
ZINC000217604028

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Available files

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