Vitas-M small molecule compound
4-[(E)-{2-[(2Z)-3-[4-(dimethylamino)phenyl]-2-{[(3-fluorophenyl)carbonyl]amino}prop-2-enoyl]hydrazinylidene}methyl]-2-methoxyphenyl 4-bromobenzoate
Catalog ID
STK190770
SMILES COc1cc(/C=N/NC(=O)/C(=C/c2ccc(cc2)N(C)C)/NC(=O)c2cccc(c2)F)ccc1OC(=O)c1ccc(cc1)Br
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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 C33H28BrFN4O5 MW 659.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H28BrFN4O5/c1-39(2)27-14-7-21(8-15-27)17-28(37-31(40)24-5-4-6-26(35)19-24)32(41)38-36-20-22-9-16-29(30(18-22)43-3)44-33(42)23-10-12-25(34)13-11-23/h4-20H,1-3H3,(H,37,40)(H,38,41)/b28-17-,36-20+InChIKey
FKJZCQVTPULBIU-YZNMXCRDSA-NSynonyms
(4((E)(((Z)3(4(dimethylamino)phenyl)2((3fluorobenzoyl)amino)prop2enoyl)hydrazinylidene)methyl)2methoxyphenyl)4bromobenzoate
4((E)(2((2Z)3(4(DIMETHYLAMINO)PHENYL)2(((3FLUOROPHENYL)CARBONYL)AMINO)PROP2ENOYL)HYDRAZINYLIDENE)METHYL)2METHOXYPHENYL4BROMOBENZOATE
CN(C)C1=CC=C(C=C1)C=C(C(=O)NN=CC2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)Br)OC)NC(=O)C4=CC(=CC=C4)F
COc1cc(C=NNC(=O)C(=Cc2ccc(cc2)N(C)C)NC(=O)c2cccc(c2)F)ccc1OC(=O)c1ccc(cc1)Br
InChI=1SC33H28BrFN4O5c139(2)2714721(81527)1728(3731(40)2454626(35)1924)32(41)3836202291629(30(1822)433)4433(42)23101225(34)131123h420H13H3(H3740)(H3841)b28173620+
MFCD01786635
ZINC000097961071
ZINC150472214
Check stock
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Check stock on Vitas-MAvailable files
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