Vitas-M small molecule compound
methyl 4-{4-[(4-chloro-2-methylphenoxy)methyl]-5-methylthiophen-2-yl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STL175518
SMILES COC(=O)C1=C(C)NC2=C(C1c1sc(c(c1)COc1ccc(cc1C)Cl)C)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 C27H30ClNO4S MW 500.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30ClNO4S/c1-14-9-18(28)7-8-21(14)33-13-17-10-22(34-16(17)3)25-23(26(31)32-6)15(2)29-19-11-27(4,5)12-20(30)24(19)25/h7-10,25,29H,11-13H2,1-6H3InChIKey
UZABTMQIKZYHHW-UHFFFAOYSA-NSynonyms
438216-32-1438216321
CC1=C(C=CC(=C1)Cl)OCC2=C(SC(=C2)C3C4=C(CC(CC4=O)(C)C)NC(=C3C(=O)OC)C)C
InChI=1SC27H30ClNO4Sc114918(28)7821(14)3313171022(3416(17)3)2523(26(31)326)15(2)29191127(45)1220(30)24(19)25h7102529H1113H216H3
methyl4(4((4chloro2methylphenoxy)methyl)5methylthiophen2yl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
methyl4(4((4chloro2methylphenoxy)methyl)5methylthiophen2yl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
MFCD03074072
ZINC000008441665
ZINC000008441666
Check stock
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