Vitas-M small molecule compound

5-[(4-{(1Z)-1-[2-({3-[(4-methyl-2-nitrophenoxy)methyl]phenyl}carbonyl)hydrazinylidene]ethyl}phenoxy)methyl]furan-2-carboxylic acid

Catalog ID
STK307813
SMILES Cc1ccc(c(c1)[N+](=O)[O-])OCc1cccc(c1)C(=O)N/N=C(\c1ccc(cc1)OCc1ccc(o1)C(=O)O)/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 C29H25N3O8 MW 543.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O8/c1-18-6-12-26(25(14-18)32(36)37)39-16-20-4-3-5-22(15-20)28(33)31-30-19(2)21-7-9-23(10-8-21)38-17-24-11-13-27(40-24)29(34)35/h3-15H,16-17H2,1-2H3,(H,31,33)(H,34,35)/b30-19-
InChIKey
DEHVTRQDUNWBCF-FSGOGVSDSA-N
Synonyms
828294-45-7
5((4((1Z)1(2((3((4methyl2nitrophenoxy)methyl)phenyl)carbonyl)hydrazinylidene)ethyl)phenoxy)methyl)furan2carboxylicacid
5((4((1Z)1METHYL2((3((4METHYL2NITROPHENOXY)METHYL)PHENYL)CARBONYLAMINO)2AZAVINYL)PHENOXY)METHYL)FURAN2CARBOXYLICACID
5((4((Z)CMETHYLN((3((4METHYL2NITROPHENOXY)METHYL)BENZOYL)AMINO)CARBONIMIDOYL)PHENOXY)METHYL)FURAN2CARBOXYLICACID
828294457
CC1=CC(=C(C=C1)OCC2=CC=CC(=C2)C(=O)NN=C(C)C3=CC=C(C=C3)OCC4=CC=C(O4)C(=O)O)(N+)(=O)(O)
Cc1ccc(c(c1)(N+)(=O)(O))OCc1cccc(c1)C(=O)NN=C(c1ccc(cc1)OCc1ccc(o1)C(=O)O)C
InChI=1SC29H25N3O8c11861226(25(1418)32(36)37)39162043522(1520)28(33)313019(2)217923(10821)381724111327(4024)29(34)35h315H1617H212H3(H3133)(H3435)b3019
MFCD06195401
ZINC000102006263
ZINC102006259

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Available files

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