Vitas-M small molecule compound
dimethyl 3,3'-{propane-1,3-diylbis[imino(1,2-dioxoethane-2,1-diyl)]}bis[2-methyl-5-oxo-1-phenyl-4-(phenylamino)-2,5-dihydro-1H-pyrrole-2-carboxylate]
Catalog ID
STL573771
SMILES COC(=O)C1(C)C(=C(C(=O)N1c1ccccc1)Nc1ccccc1)C(=O)C(=O)NCCCNC(=O)C(=O)C1=C(Nc2ccccc2)C(=O)N(C1(C)C(=O)OC)c1ccccc1
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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 C45H42N6O10 MW 826.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C45H42N6O10/c1-44(42(58)60-3)32(34(48-28-18-9-5-10-19-28)40(56)50(44)30-22-13-7-14-23-30)36(52)38(54)46-26-17-27-47-39(55)37(53)33-35(49-29-20-11-6-12-21-29)41(57)51(31-24-15-8-16-25-31)45(33,2)43(59)61-4/h5-16,18-25,48-49H,17,26-27H2,1-4H3,(H,46InChIKey
JYIOJTWQRMYKQK-UHFFFAOYSA-NSynonyms
102565261
dimethyl33(propane13diylbis(imino(12dioxoethane21diyl)))bis(2methyl5oxo1phenyl4(phenylamino)25dihydro1Hpyrrole2carboxylate)
InChI=1SC45H42N6O10c144(42(58)603)32(34(48281895101928)40(56)50(44)3022137142330)36(52)38(54)462617274739(55)37(53)3335(492920116122129)41(57)51(3124158162531)45(332)43(59)614h51618254849H172627H214H3(H4654)(H4755)
methyl4anilino3(2(3((2(4anilino2methoxycarbonyl2methyl5oxo1phenylpyrrol3yl)2oxoacetyl)amino)propylamino)2oxoacetyl)2methyl5oxo1phenylpyrrole2carboxylate
MFCD26098251
ZINC000150417516
ZINC000150417538
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