Vitas-M small molecule compound

2-[(2-chloro-6-ethoxy-4-{(E)-[1-(4-fluorobenzyl)-2,5-dioxoimidazolidin-4-ylidene]methyl}phenoxy)methyl]benzonitrile

Catalog ID
STK389011
SMILES CCOc1cc(/C=C\2/NC(=O)N(C2=O)Cc2ccc(cc2)F)cc(c1OCc1ccccc1C#N)Cl

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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 C27H21ClFN3O4 MW 505.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21ClFN3O4/c1-2-35-24-13-18(11-22(28)25(24)36-16-20-6-4-3-5-19(20)14-30)12-23-26(33)32(27(34)31-23)15-17-7-9-21(29)10-8-17/h3-13H,2,15-16H2,1H3,(H,31,34)/b23-12+
InChIKey
SWEVYOMKYYASNR-FSJBWODESA-N
Synonyms

2((2CHLORO6ETHOXY4((1((4FLUOROPHENYL)METHYL)25DIOXO(13DIAZOLIDIN4YLIDENE))METHYL)PHENOXY)METHYL)BENZENECARBONITRILE
2((2CHLORO6ETHOXY4((E)(1((4FLUOROPHENYL)METHYL)25DIOXOIMIDAZOLIDIN4YLIDENE)METHYL)PHENOXY)METHYL)BENZONITRILE
2((2chloro6ethoxy4((E)(1(4fluorobenzyl)25dioxoimidazolidin4ylidene)methyl)phenoxy)methyl)benzonitrile
CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=O)N2)CC3=CC=C(C=C3)F)Cl)OCC4=CC=CC=C4C#N
CCOc1cc(C=C2NC(=O)N(C2=O)Cc2ccc(cc2)F)cc(c1OCc1ccccc1C#N)Cl
InChI=1SC27H21ClFN3O4c1235241318(1122(28)25(24)361620643519(20)1430)122326(33)32(27(34)3123)15177921(29)10817h313H21516H21H3(H3134)b2312+
MFCD04966539
ZINC000015945832
ZINC15945832

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Available files

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