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2-[4-(8-phenylmethoxyoctyl)phenyl]benzenecarbothioamide

2-[4-(8-phenylmethoxyoctyl)phenyl]benzenecarbothioamide

Systemtic Name:2-[4-(8-phenylmethoxyoctyl)phenyl]benzenecarbothioamide
Openeye Name:2-[4-(8-benzyloxyoctyl)phenyl]benzenecarbothioamide
CAS Name:2-[4-(8-phenylmethoxyoctyl)phenyl]benzenecarbothioamide
IUPAC Name:2-[4-(8-phenylmethoxyoctyl)phenyl]benzenecarbothioamide
Traditional Name:2-[4-(8-benzoxyoctyl)phenyl]thiobenzamide
Formula: C28H33NOS
MolecularWeight: 431.63272
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCCCCCCCC2=CC=C(C=C2)C3=CC=CC=C3C(=S)N


Isomeric SMILES

C1=CC=C(C=C1)COCCCCCCCCC2=CC=C(C=C2)C3=CC=CC=C3C(=S)N


InChI

InChI=1S/C28H33NOS/c29-28(31)27-16-10-9-15-26(27)25-19-17-23(18-20-25)12-6-3-1-2-4-11-21-30-22-24-13-7-5-8-14-24/h5,7-10,13-20H,1-4,6,11-12,21-22H2,(H2,29,31)


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