N-[[2-(2-phenoxyethoxy)phenyl]carbamothioyl]octanamide

Systemtic Name: N-[[2-(2-phenoxyethoxy)phenyl]carbamothioyl]octanamide Openeye Name: N-[[2-(2-phenoxyethoxy)phenyl]carbamothioyl]octanamide CAS Name: N-[[2-(2-phenoxyethoxy)anilino]-sulfanylidenemethyl]octanamide IUPAC Name: N-[[2-(2-phenoxyethoxy)phenyl]carbamothioyl]octanamide Traditional Name: N-[[2-(2-phenoxyethoxy)phenyl]thiocarbamoyl]caprylamide Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NC1=CC=CC=C1OCCOC2=CC=CC=C2

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NC1=CC=CC=C1OCCOC2=CC=CC=C2

InChI

InChI=1S/C23H30N2O3S/c1-2-3-4-5-9-16-22(26)25-23(29)24-20-14-10-11-15-21(20)28-18-17-27-19-12-7-6-8-13-19/h6-8,10-15H,2-5,9,16-18H2,1H3,(H2,24,25,26,29)