Vitas-M small molecule compound
ethyl (4Z)-4-{[5-({[(4-bromophenyl)sulfonyl]amino}methyl)furan-2-yl]methylidene}-1-(3,4-dimethylphenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK052646
SMILES CCOC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(o1)CNS(=O)(=O)c1ccc(cc1)Br)c1ccc(c(c1)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 C28H27BrN2O6S MW 599.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27BrN2O6S/c1-5-36-28(33)26-19(4)31(21-9-6-17(2)18(3)14-21)27(32)25(26)15-22-10-11-23(37-22)16-30-38(34,35)24-12-7-20(29)8-13-24/h6-15,30H,5,16H2,1-4H3/b25-15-InChIKey
BNXWHVRLMHHAJX-MYYYXRDXSA-NSynonyms
CCOC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(o1)CNS(=O)(=O)c1ccc(cc1)Br)c1ccc(c(c1)C)C
CCOC(=O)C1=C(N(C(=O)C1=CC2=CC=C(O2)CNS(=O)(=O)C3=CC=C(C=C3)Br)C4=CC(=C(C=C4)C)C)C
ETHYL(4Z)4((5((((4BROMOPHENYL)SULFONYL)AMINO)METHYL)FURAN2YL)METHYLIDENE)1(34DIMETHYLPHENYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
ETHYL(4Z)4((5(((4BROMOPHENYL)SULFONYLAMINO)METHYL)FURAN2YL)METHYLIDENE)1(34DIMETHYLPHENYL)2METHYL5OXOPYRROLE3CARBOXYLATE
InChI=1SC28H27BrN2O6Sc153628(33)2619(4)31(219617(2)18(3)1421)27(32)25(26)1522101123(3722)163038(3435)2412720(29)81324h61530H516H214H3b2515
MFCD08051167
STK052646
ZINC000097944420
ZINC97944420
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.