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2-(1,4,5-triphenylimidazol-2-yl)sulfanyldecanoic acid

2-(1,4,5-triphenylimidazol-2-yl)sulfanyldecanoic acid

Systemtic Name:2-(1,4,5-triphenylimidazol-2-yl)sulfanyldecanoic acid
Openeye Name:2-(1,4,5-triphenylimidazol-2-yl)sulfanyldecanoic acid
CAS Name:2-[(1,4,5-triphenyl-2-imidazolyl)thio]decanoic acid
IUPAC Name:2-(1,4,5-triphenylimidazol-2-yl)sulfanyldecanoic acid
Traditional Name:2-[(1,4,5-triphenylimidazol-2-yl)thio]capric acid
Formula: C31H34N2O2S
MolecularWeight: 498.67886
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C(=O)O)SC1=NC(=C(N1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4


Isomeric SMILES

CCCCCCCCC(C(=O)O)SC1=NC(=C(N1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4


InChI

InChI=1S/C31H34N2O2S/c1-2-3-4-5-6-16-23-27(30(34)35)36-31-32-28(24-17-10-7-11-18-24)29(25-19-12-8-13-20-25)33(31)26-21-14-9-15-22-26/h7-15,17-22,27H,2-6,16,23H2,1H3,(H,34,35)


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