Vitas-M small molecule compound
ethyl 2-amino-4-(5-bromothiophen-2-yl)-7,7-dimethyl-5-oxo-1-(4-sulfamoylphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK768747
SMILES CCOC(=O)C1=C(N)N(C2=C(C1c1ccc(s1)Br)C(=O)CC(C2)(C)C)c1ccc(cc1)S(=O)(=O)N
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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 C24H26BrN3O5S2 MW 580.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26BrN3O5S2/c1-4-33-23(30)21-20(17-9-10-18(25)34-17)19-15(11-24(2,3)12-16(19)29)28(22(21)26)13-5-7-14(8-6-13)35(27,31)32/h5-10,20H,4,11-12,26H2,1-3H3,(H2,27,31,32)InChIKey
GRRYFINCONOXMF-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(C2=C(C1C3=CC=C(S3)Br)C(=O)CC(C2)(C)C)C4=CC=C(C=C4)S(=O)(=O)N)N
ethyl2amino4(5bromothiophen2yl)77dimethyl5oxo1(4sulfamoylphenyl)145678hexahydroquinoline3carboxylate
ETHYL2AMINO4(5BROMOTHIOPHEN2YL)77DIMETHYL5OXO1(4SULFAMOYLPHENYL)68DIHYDRO4HQUINOLINE3CARBOXYLATE
InChI=1SC24H26BrN3O5S2c143323(30)2120(1791018(25)3417)1915(1124(23)1216(19)29)28(22(21)26)135714(8613)35(2731)32h51020H4111226H213H3(H2273132)
MFCD03307749
ZINC000003619667
ZINC000003619670
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