Vitas-M small molecule compound

4-{(2Z)-2-[3-ethoxy-4-(2-{[4-(ethoxycarbonyl)phenyl]amino}-2-oxoethoxy)benzylidene]hydrazinyl}benzoic acid

Catalog ID
STL172389
SMILES CCOc1cc(/C=N\Nc2ccc(cc2)C(=O)O)ccc1OCC(=O)Nc1ccc(cc1)C(=O)OCC

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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 C27H27N3O7 MW 505.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O7/c1-3-35-24-15-18(16-28-30-22-12-6-19(7-13-22)26(32)33)5-14-23(24)37-17-25(31)29-21-10-8-20(9-11-21)27(34)36-4-2/h5-16,30H,3-4,17H2,1-2H3,(H,29,31)(H,32,33)/b28-16-
InChIKey
HGCXQASYYNQUNZ-NTFVMDSBSA-N
Synonyms

4((2Z)2((3ETHOXY4(2(4ETHOXYCARBONYLANILINO)2OXOETHOXY)PHENYL)METHYLIDENE)HYDRAZINYL)BENZOICACID
4((2Z)2(3ethoxy4(2((4(ethoxycarbonyl)phenyl)amino)2oxoethoxy)benzylidene)hydrazinyl)benzoicacid
4(2(3ETHOXY4(2(4(ETHOXYCARBONYL)ANILINO)2OXOETHOXY)BENZYLIDENE)HYDRAZINO)BENZOICACID
CCOC1=C(C=CC(=C1)C=NNC2=CC=C(C=C2)C(=O)O)OCC(=O)NC3=CC=C(C=C3)C(=O)OCC
CCOc1cc(C=NNc2ccc(cc2)C(=O)O)ccc1OCC(=O)Nc1ccc(cc1)C(=O)OCC
InChI=1SC27H27N3O7c1335241518(1628302212619(71322)26(32)33)51423(24)371725(31)292110820(91121)27(34)3642h51630H3417H212H3(H2931)(H3233)b2816
MFCD02054296
ZINC000032465108
ZINC16688928

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Available files

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