Vitas-M small molecule compound
3-[(E)-(2-{(2E)-3-(3,4-dimethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}hydrazinylidene)methyl]phenyl 3-fluorobenzoate
Catalog ID
STK150770
SMILES COc1cc(ccc1OC)/C=C(\C(=O)N/N=C/c1cccc(c1)OC(=O)c1cccc(c1)F)/NC(=O)c1ccccc1
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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 C32H26FN3O6 MW 567.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H26FN3O6/c1-40-28-15-14-21(18-29(28)41-2)17-27(35-30(37)23-9-4-3-5-10-23)31(38)36-34-20-22-8-6-13-26(16-22)42-32(39)24-11-7-12-25(33)19-24/h3-20H,1-2H3,(H,35,37)(H,36,38)/b27-17+,34-20+InChIKey
HLNQYASKTVSUOH-XCTFGQCESA-NSynonyms
(3((E)(((E)2benzamido3(34dimethoxyphenyl)prop2enoyl)hydrazinylidene)methyl)phenyl)3fluorobenzoate
3((E)(2((2E)3(34DIMETHOXYPHENYL)2((PHENYLCARBONYL)AMINO)PROP2ENOYL)HYDRAZINYLIDENE)METHYL)PHENYL3FLUOROBENZOATE
COC1=C(C=C(C=C1)C=C(C(=O)NN=CC2=CC(=CC=C2)OC(=O)C3=CC(=CC=C3)F)NC(=O)C4=CC=CC=C4)OC
COc1cc(ccc1OC)C=C(C(=O)NN=Cc1cccc(c1)OC(=O)c1cccc(c1)F)NC(=O)c1ccccc1
InChI=1SC32H26FN3O6c14028151421(1829(28)412)1727(3530(37)2394351023)31(38)36342022861326(1622)4232(39)241171225(33)1924h320H12H3(H3537)(H3638)b2717+3420+
MFCD01146732
ZINC000097960472
ZINC101626607
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