Vitas-M small molecule compound

methyl (4Z)-1-(4-methoxyphenyl)-2-methyl-5-oxo-4-{[5-({[oxo(phenylamino)acetyl]amino}methyl)furan-2-yl]methylidene}-4,5-dihydro-1H-pyrrole-3-carboxylate

Catalog ID
STK165168
SMILES COc1ccc(cc1)N1C(=C(/C(=C/c2ccc(o2)CNC(=O)C(=O)Nc2ccccc2)/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 C28H25N3O7 MW 515.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O7/c1-17-24(28(35)37-3)23(27(34)31(17)19-9-11-20(36-2)12-10-19)15-21-13-14-22(38-21)16-29-25(32)26(33)30-18-7-5-4-6-8-18/h4-15H,16H2,1-3H3,(H,29,32)(H,30,33)/b23-15-
InChIKey
FFQOTTSRIBXWLV-HAHDFKILSA-N
Synonyms

CC1=C(C(=CC2=CC=C(O2)CNC(=O)C(=O)NC3=CC=CC=C3)C(=O)N1C4=CC=C(C=C4)OC)C(=O)OC
COc1ccc(cc1)N1C(=C(C(=Cc2ccc(o2)CNC(=O)C(=O)Nc2ccccc2)C1=O)C(=O)OC)C
InChI=1SC28H25N3O7c11724(28(35)373)23(27(34)31(17)1991120(362)121019)1521131422(3821)162925(32)26(33)30187546818h415H16H213H3(H2932)(H3033)b2315
METHYL(4Z)1(4METHOXYPHENYL)2METHYL5OXO4((5(((OXO(PHENYLAMINO)ACETYL)AMINO)METHYL)FURAN2YL)METHYLIDENE)45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)4((5(((2ANILINO2OXOACETYL)AMINO)METHYL)FURAN2YL)METHYLIDENE)1(4METHOXYPHENYL)2METHYL5OXOPYRROLE3CARBOXYLATE
MFCD08679496
ZINC000002078476
ZINC02078476
ZINC2078476

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.