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NEO-823 - >98.0%(HPLC), high purity , CAS No.1267603-73-5
Basic Description
Synonyms | 2-[4-[2-[5-[2-(Benzyloxy)-4-(dibutylamino)styryl]thiophen-2-yl]vinyl]-3-cyano-5-phenyl-5-(trifluoromethyl)furan-2(5 | H | )-ylidene]malononitrile | 2-[3-Cyano-4-[2-[5-[2-[4-(dibutylamino)-2-(phenylmethoxy)phenyl]ethenyl]-2-thienyl]ethenyl]-5-phenyl-5-(trifluoro |
Specifications & Purity | ≥98%(HPLC) |
Shipped In | Normal |
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Names and Identifiers
IUPAC Name | 2-[3-cyano-4-[(E)-2-[5-[(E)-2-[4-(dibutylamino)-2-phenylmethoxyphenyl]ethenyl]thiophen-2-yl]ethenyl]-5-phenyl-5-(trifluoromethyl)furan-2-ylidene]propanedinitrile |
INCHI | InChI=1S/C44H39F3N4O2S/c1-3-5-25-51(26-6-4-2)36-19-17-33(41(27-36)52-31-32-13-9-7-10-14-32)18-20-37-21-22-38(54-37)23-24-40-39(30-50)42(34(28-48)29-49)53-43(40,44(45,46)47)35-15-11-8-12-16-35/h7-24,27H,3-6,25-26,31H2,1-2H3/b20-18+,24-23+ |
InChi Key | SXFGKYGUYHUANQ-NRJODPMSSA-N |
Canonical SMILES | CCCCN(CCCC)C1=CC(=C(C=C1)C=CC2=CC=C(S2)C=CC3=C(C(=C(C#N)C#N)OC3(C4=CC=CC=C4)C(F)(F)F)C#N)OCC5=CC=CC=C5 |
Isomeric SMILES | CCCCN(CCCC)C1=CC(=C(C=C1)/C=C/C2=CC=C(S2)/C=C/C3=C(C(=C(C#N)C#N)OC3(C4=CC=CC=C4)C(F)(F)F)C#N)OCC5=CC=CC=C5 |
PubChem CID | 88549116 |
Molecular Weight | 744.88 |
Reaxy-Rn | 22678215 |
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