N-[(3-propoxyphenyl)carbamothioyl]octanamide

Systemtic Name: N-[(3-propoxyphenyl)carbamothioyl]octanamide Openeye Name: N-[(3-propoxyphenyl)carbamothioyl]octanamide CAS Name: N-[(3-propoxyanilino)-sulfanylidenemethyl]octanamide IUPAC Name: N-[(3-propoxyphenyl)carbamothioyl]octanamide Traditional Name: N-[(3-propoxyphenyl)thiocarbamoyl]caprylamide Formula: C18H28N2O2S MolecularWeight: 336.49212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NC1=CC(=CC=C1)OCCC

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NC1=CC(=CC=C1)OCCC

InChI

InChI=1S/C18H28N2O2S/c1-3-5-6-7-8-12-17(21)20-18(23)19-15-10-9-11-16(14-15)22-13-4-2/h9-11,14H,3-8,12-13H2,1-2H3,(H2,19,20,21,23)