Vitas-M small molecule compound
2-(ethylsulfanyl)ethyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-7-(2-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK403048
SMILES CCSCCOC(=O)C1=C(C)NC2=C(C1c1cc(OC)c(c(c1)[N+](=O)[O-])O)C(=O)CC(C2)c1ccccc1OC
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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 C29H32N2O8S MW 568.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N2O8S/c1-5-40-11-10-39-29(34)25-16(2)30-20-12-17(19-8-6-7-9-23(19)37-3)14-22(32)27(20)26(25)18-13-21(31(35)36)28(33)24(15-18)38-4/h6-9,13,15,17,26,30,33H,5,10-12,14H2,1-4H3InChIKey
VYFAYGSOYMVZNR-UHFFFAOYSA-NSynonyms
2(ethylsulfanyl)ethyl4(4hydroxy3methoxy5nitrophenyl)7(2methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2ethylsulfanylethyl4(4hydroxy3methoxy5nitrophenyl)7(2methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CCSCCOC(=O)C1=C(C)NC2=C(C1c1cc(OC)c(c(c1)(N+)(=O)(O))O)C(=O)CC(C2)c1ccccc1OC
CCSCCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C(=C3)OC)O)(N+)(=O)(O))C(=O)CC(C2)C4=CC=CC=C4OC)C
InChI=1SC29H32N2O8Sc154011103929(34)2516(2)30201217(19867923(19)373)1422(32)27(20)26(25)181321(31(35)36)28(33)24(1518)384h69131517263033H5101214H214H3
MFCD03371055
ZINC000097939772
ZINC000097939775
Check stock
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