Vitas-M small molecule compound
methyl (4Z)-4-{[5-({[(4-bromophenyl)sulfonyl]amino}methyl)furan-2-yl]methylidene}-1-(2-methoxyethyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK165734
SMILES COCCN1C(=C(/C(=C/c2ccc(o2)CNS(=O)(=O)c2ccc(cc2)Br)/C1=O)C(=O)OC)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 C22H23BrN2O7S MW 539.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23BrN2O7S/c1-14-20(22(27)31-3)19(21(26)25(14)10-11-30-2)12-16-6-7-17(32-16)13-24-33(28,29)18-8-4-15(23)5-9-18/h4-9,12,24H,10-11,13H2,1-3H3/b19-12-InChIKey
NEPOVDADHWNJRB-UNOMPAQXSA-NSynonyms
CC1=C(C(=CC2=CC=C(O2)CNS(=O)(=O)C3=CC=C(C=C3)Br)C(=O)N1CCOC)C(=O)OC
COCCN1C(=C(C(=Cc2ccc(o2)CNS(=O)(=O)c2ccc(cc2)Br)C1=O)C(=O)OC)C
InChI=1SC22H23BrN2O7Sc11420(22(27)313)19(21(26)25(14)1011302)12166717(3216)132433(2829)188415(23)5918h491224H101113H213H3b1912
METHYL(4Z)4((5((((4BROMOPHENYL)SULFONYL)AMINO)METHYL)FURAN2YL)METHYLIDENE)1(2METHOXYETHYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)4((5(((4BROMOPHENYL)SULFONYLAMINO)METHYL)FURAN2YL)METHYLIDENE)1(2METHOXYETHYL)2METHYL5OXOPYRROLE3CARBOXYLATE
MFCD03922857
ZINC000097960456
ZINC97960456
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