Vitas-M small molecule compound

cyclohexyl 7-(4-chlorophenyl)-2-methyl-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK378730
SMILES Clc1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1cccnc1)C(=O)OC1CCCCC1)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 C28H29ClN2O3 MW 477.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29ClN2O3/c1-17-25(28(33)34-22-7-3-2-4-8-22)26(19-6-5-13-30-16-19)27-23(31-17)14-20(15-24(27)32)18-9-11-21(29)12-10-18/h5-6,9-13,16,20,22,26,31H,2-4,7-8,14-15H2,1H3
InChIKey
ZHHJIELRLNMQFU-UHFFFAOYSA-N
Synonyms

CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=CN=CC=C4)C(=O)OC5CCCCC5
cyclohexyl7(4chlorophenyl)2methyl5oxo4(pyridin3yl)145678hexahydroquinoline3carboxylate
cyclohexyl7(4chlorophenyl)2methyl5oxo4pyridin3yl4678tetrahydro1Hquinoline3carboxylate
InChI=1SC28H29ClN2O3c11725(28(33)34227324822)26(196513301619)2723(3117)1420(1524(27)32)1891121(29)121018h569131620222631H24781415H21H3
MFCD01824424
ZINC000019762403
ZINC000019762411

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Available files

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