Vitas-M small molecule compound
methyl 2-amino-4-(4-nitrophenyl)-5-oxo-1-(4-sulfamoylphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK756881
SMILES COC(=O)C1=C(N)N(c2ccc(cc2)S(=O)(=O)N)C2=C(C1c1ccc(cc1)[N+](=O)[O-])C(=O)CCC2
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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 C23H22N4O7S MW 498.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O7S/c1-34-23(29)21-19(13-5-7-15(8-6-13)27(30)31)20-17(3-2-4-18(20)28)26(22(21)24)14-9-11-16(12-10-14)35(25,32)33/h5-12,19H,2-4,24H2,1H3,(H2,25,32,33)InChIKey
JJXNEZHWCGTJMM-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(N(C2=C(C1C3=CC=C(C=C3)(N+)(=O)(O))C(=O)CCC2)C4=CC=C(C=C4)S(=O)(=O)N)N
COC(=O)C1=C(N)N(c2ccc(cc2)S(=O)(=O)N)C2=C(C1c1ccc(cc1)(N+)(=O)(O))C(=O)CCC2
InChI=1SC23H22N4O7Sc13423(29)2119(135715(8613)27(30)31)2017(32418(20)28)26(22(21)24)1491116(121014)35(2532)33h51219H2424H21H3(H2253233)
methyl2amino4(4nitrophenyl)5oxo1(4sulfamoylphenyl)145678hexahydroquinoline3carboxylate
methyl2amino4(4nitrophenyl)5oxo1(4sulfamoylphenyl)4678tetrahydroquinoline3carboxylate
MFCD01305791
ZINC000003664522
ZINC000003664523
Check stock
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Check stock on Vitas-MAvailable files
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