N-[[2-(3-phenylpropoxy)phenyl]carbamothioyl]octanamide

Systemtic Name: N-[[2-(3-phenylpropoxy)phenyl]carbamothioyl]octanamide Openeye Name: N-[[2-(3-phenylpropoxy)phenyl]carbamothioyl]octanamide CAS Name: N-[[2-(3-phenylpropoxy)anilino]-sulfanylidenemethyl]octanamide IUPAC Name: N-[[2-(3-phenylpropoxy)phenyl]carbamothioyl]octanamide Traditional Name: N-[[2-(3-phenylpropoxy)phenyl]thiocarbamoyl]caprylamide Formula: C24H32N2O2S MolecularWeight: 412.58808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NC1=CC=CC=C1OCCCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NC1=CC=CC=C1OCCCC2=CC=CC=C2

InChI

InChI=1S/C24H32N2O2S/c1-2-3-4-5-9-18-23(27)26-24(29)25-21-16-10-11-17-22(21)28-19-12-15-20-13-7-6-8-14-20/h6-8,10-11,13-14,16-17H,2-5,9,12,15,18-19H2,1H3,(H2,25,26,27,29)