N-[[4-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]octanamide

Systemtic Name: N-[[4-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]octanamide Openeye Name: N-[[4-(tetrahydrofuran-2-ylmethoxy)phenyl]carbamothioyl]octanamide CAS Name: N-[[4-(2-oxolanylmethoxy)anilino]-sulfanylidenemethyl]octanamide IUPAC Name: N-[[4-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]octanamide Traditional Name: N-[[4-(tetrahydrofurfuryloxy)phenyl]thiocarbamoyl]caprylamide Formula: C20H30N2O3S MolecularWeight: 378.5288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NC1=CC=C(C=C1)OCC2CCCO2

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NC1=CC=C(C=C1)OCC2CCCO2

InChI

InChI=1S/C20H30N2O3S/c1-2-3-4-5-6-9-19(23)22-20(26)21-16-10-12-17(13-11-16)25-15-18-8-7-14-24-18/h10-13,18H,2-9,14-15H2,1H3,(H2,21,22,23,26)