Vitas-M small molecule compound
2-phenylethyl 4-(4-chlorophenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK403010
SMILES Clc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CC(C2)c1cccs1)C(=O)OCCc1ccccc1
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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 C29H26ClNO3S MW 504.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26ClNO3S/c1-18-26(29(33)34-14-13-19-6-3-2-4-7-19)27(20-9-11-22(30)12-10-20)28-23(31-18)16-21(17-24(28)32)25-8-5-15-35-25/h2-12,15,21,27,31H,13-14,16-17H2,1H3InChIKey
GOEUBBWMCWJGBE-UHFFFAOYSA-NSynonyms
2phenylethyl4(4chlorophenyl)2methyl5oxo7(thiophen2yl)145678hexahydroquinoline3carboxylate
2phenylethyl4(4chlorophenyl)2methyl5oxo7thiophen2yl4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CS3)C4=CC=C(C=C4)Cl)C(=O)OCCC5=CC=CC=C5
InChI=1SC29H26ClNO3Sc11826(29(33)341413196324719)27(2091122(30)121020)2823(3118)1621(1724(28)32)2585153525h21215212731H13141617H21H3
MFCD03371025
ZINC000001074679
ZINC000001074811
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