Vitas-M small molecule compound

4-bromo-2-[(E)-(2-{[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetyl}hydrazinylidene)methyl]phenyl (2E)-3-(furan-2-yl)prop-2-enoate

Catalog ID
STK005769
SMILES O=C(COc1ccc(cc1)C(CC(C)(C)C)(C)C)N/N=C/c1cc(Br)ccc1OC(=O)/C=C/c1ccco1

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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 C30H33BrN2O5 MW 581.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33BrN2O5/c1-29(2,3)20-30(4,5)22-8-11-25(12-9-22)37-19-27(34)33-32-18-21-17-23(31)10-14-26(21)38-28(35)15-13-24-7-6-16-36-24/h6-18H,19-20H2,1-5H3,(H,33,34)/b15-13+,32-18+
InChIKey
UPUWTKDKDQECKN-IOEWWAGXSA-N
Synonyms

(4bromo2((E)((2(4(244trimethylpentan2yl)phenoxy)acetyl)hydrazinylidene)methyl)phenyl)(E)3(furan2yl)prop2enoate
4BROMO2((E)(2((4(244TRIMETHYLPENTAN2YL)PHENOXY)ACETYL)HYDRAZINYLIDENE)METHYL)PHENYL(2E)3(FURAN2YL)PROP2ENOATE
CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCC(=O)NN=CC2=C(C=CC(=C2)Br)OC(=O)C=CC3=CC=CO3
InChI=1SC30H33BrN2O5c129(23)2030(45)2281125(12922)371927(34)333218211723(31)101426(21)3828(35)15132476163624h618H1920H215H3(H3334)b1513+3218+
MFCD00651401
O=C(COc1ccc(cc1)C(CC(C)(C)C)(C)C)NN=Cc1cc(Br)ccc1OC(=O)C=Cc1ccco1
STK005769
ZINC000006074279
ZINC101378693

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Available files

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