Vitas-M small molecule compound
2-phenylethyl 4-(2,4-dichlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363391
SMILES Clc1ccc(c(c1)Cl)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)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 C27H27Cl2NO3 MW 484.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27Cl2NO3/c1-16-23(26(32)33-12-11-17-7-5-4-6-8-17)24(19-10-9-18(28)13-20(19)29)25-21(30-16)14-27(2,3)15-22(25)31/h4-10,13,24,30H,11-12,14-15H2,1-3H3InChIKey
JXJUWUZOISSIHE-UHFFFAOYSA-NSynonyms
313244-72-32phenylethyl4(24dichlorophenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
2phenylethyl4(24dichlorophenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
313244723
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=C(C=C(C=C3)Cl)Cl)C(=O)OCCC4=CC=CC=C4
InChI=1SC27H27Cl2NO3c11623(26(32)331211177546817)24(1910918(28)1320(19)29)2521(3016)1427(23)1522(25)31h410132430H11121415H213H3
MFCD01367245
ZINC000002082296
ZINC000002082297
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