Vitas-M small molecule compound
methyl (5Z)-1-(4-bromophenyl)-5-(4-{2-[(2-methoxyphenyl)amino]-2-oxoethoxy}benzylidene)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK169283
SMILES COC(=O)C1=C(C)N(/C(=C\c2ccc(cc2)OCC(=O)Nc2ccccc2OC)/C1=O)c1ccc(cc1)Br
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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 C29H25BrN2O6 MW 577.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25BrN2O6/c1-18-27(29(35)37-3)28(34)24(32(18)21-12-10-20(30)11-13-21)16-19-8-14-22(15-9-19)38-17-26(33)31-23-6-4-5-7-25(23)36-2/h4-16H,17H2,1-3H3,(H,31,33)/b24-16-InChIKey
JDWZJRIJXFYFRI-JLPGSUDCSA-NSynonyms
CC1=C(C(=O)C(=CC2=CC=C(C=C2)OCC(=O)NC3=CC=CC=C3OC)N1C4=CC=C(C=C4)Br)C(=O)OC
COC(=O)C1=C(C)N(C(=Cc2ccc(cc2)OCC(=O)Nc2ccccc2OC)C1=O)c1ccc(cc1)Br
InChI=1SC29H25BrN2O6c11827(29(35)373)28(34)24(32(18)21121020(30)111321)161981422(15919)381726(33)3123645725(23)362h416H17H213H3(H3133)b2416
METHYL(5Z)1(4BROMOPHENYL)5((4(2(2METHOXYANILINO)2OXOETHOXY)PHENYL)METHYLIDENE)2METHYL4OXOPYRROLE3CARBOXYLATE
METHYL(5Z)1(4BROMOPHENYL)5(4(2((2METHOXYPHENYL)AMINO)2OXOETHOXY)BENZYLIDENE)2METHYL4OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD01987268
ZINC000059821534
ZINC59821534
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