Vitas-M small molecule compound
methyl (5E)-2-methyl-1-(4-methylphenyl)-4-oxo-5-[(5-{[(phenylsulfonyl)amino]methyl}furan-2-yl)methylidene]-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK877797
SMILES COC(=O)C1=C(C)N(/C(=C/c2ccc(o2)CNS(=O)(=O)c2ccccc2)/C1=O)c1ccc(cc1)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 C26H24N2O6S MW 492.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O6S/c1-17-9-11-19(12-10-17)28-18(2)24(26(30)33-3)25(29)23(28)15-20-13-14-21(34-20)16-27-35(31,32)22-7-5-4-6-8-22/h4-15,27H,16H2,1-3H3/b23-15+InChIKey
BFODBTUNXNCYKG-HZHRSRAPSA-NSynonyms
(E)methyl2methyl4oxo5((5(phenylsulfonamidomethyl)furan2yl)methylene)1(ptolyl)45dihydro1Hpyrrole3carboxylate
CC1=CC=C(C=C1)N2C(=C(C(=O)C2=CC3=CC=C(O3)CNS(=O)(=O)C4=CC=CC=C4)C(=O)OC)C
COC(=O)C1=C(C)N(C(=Cc2ccc(o2)CNS(=O)(=O)c2ccccc2)C1=O)c1ccc(cc1)C
InChI=1SC26H24N2O6Sc11791119(121017)2818(2)24(26(30)333)25(29)23(28)1520131421(3420)162735(3132)227546822h41527H16H213H3b2315+
methyl(5E)2methyl1(4methylphenyl)4oxo5((5(((phenylsulfonyl)amino)methyl)furan2yl)methylidene)45dihydro1Hpyrrole3carboxylate
METHYL(5E)5((5(BENZENESULFONAMIDOMETHYL)FURAN2YL)METHYLIDENE)2METHYL1(4METHYLPHENYL)4OXOPYRROLE3CARBOXYLATE
MFCD02222773
ZINC000009348809
ZINC09348809
ZINC9348809
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