Vitas-M small molecule compound

3-({2-methoxy-4-[(Z)-(1-{2-[(4-methylphenyl)amino]-2-oxoethyl}-2,5-dioxoimidazolidin-4-ylidene)methyl]phenoxy}methyl)benzoic acid

Catalog ID
STK162798
SMILES COc1cc(ccc1OCc1cccc(c1)C(=O)O)/C=C/1\NC(=O)N(C1=O)CC(=O)Nc1ccc(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 C28H25N3O7 MW 515.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O7/c1-17-6-9-21(10-7-17)29-25(32)15-31-26(33)22(30-28(31)36)13-18-8-11-23(24(14-18)37-2)38-16-19-4-3-5-20(12-19)27(34)35/h3-14H,15-16H2,1-2H3,(H,29,32)(H,30,36)(H,34,35)/b22-13-
InChIKey
VUQCYZLXUKVIIA-XKZIYDEJSA-N
Synonyms

3((2METHOXY4((1((N(4METHYLPHENYL)CARBAMOYL)METHYL)25DIOXO(13DIAZOLIDIN4YLIDENE))METHYL)PHENOXY)METHYL)BENZOICACID
3((2METHOXY4((Z)(1(2((4METHYLPHENYL)AMINO)2OXOETHYL)25DIOXOIMIDAZOLIDIN4YLIDENE)METHYL)PHENOXY)METHYL)BENZOICACID
3((2METHOXY4((Z)(1(2(4METHYLANILINO)2OXOETHYL)25DIOXOIMIDAZOLIDIN4YLIDENE)METHYL)PHENOXY)METHYL)BENZOICACID
CC1=CC=C(C=C1)NC(=O)CN2C(=O)C(=CC3=CC(=C(C=C3)OCC4=CC=CC(=C4)C(=O)O)OC)NC2=O
COc1cc(ccc1OCc1cccc(c1)C(=O)O)C=C1NC(=O)N(C1=O)CC(=O)Nc1ccc(cc1)C
InChI=1SC28H25N3O7c1176921(10717)2925(32)153126(33)22(3028(31)36)131881123(24(1418)372)38161943520(1219)27(34)35h314H1516H212H3(H2932)(H3036)(H3435)b2213
MFCD04319103
ZINC000008816369
ZINC8816369

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Available files

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