N-[(3-phenethyloxyphenyl)carbamothioyl]octanamide

Systemtic Name: N-[(3-phenethyloxyphenyl)carbamothioyl]octanamide Openeye Name: N-[(3-phenethyloxyphenyl)carbamothioyl]octanamide CAS Name: N-[(3-phenethyloxyanilino)-sulfanylidenemethyl]octanamide IUPAC Name: N-[(3-phenethyloxyphenyl)carbamothioyl]octanamide Traditional Name: N-[(3-phenethyloxyphenyl)thiocarbamoyl]caprylamide Formula: C23H30N2O2S MolecularWeight: 398.5615

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NC1=CC(=CC=C1)OCCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NC1=CC(=CC=C1)OCCC2=CC=CC=C2

InChI

InChI=1S/C23H30N2O2S/c1-2-3-4-5-9-15-22(26)25-23(28)24-20-13-10-14-21(18-20)27-17-16-19-11-7-6-8-12-19/h6-8,10-14,18H,2-5,9,15-17H2,1H3,(H2,24,25,26,28)