N-[(4-hexoxyphenyl)carbamothioyl]octanamide

Systemtic Name: N-[(4-hexoxyphenyl)carbamothioyl]octanamide Openeye Name: N-[(4-hexoxyphenyl)carbamothioyl]octanamide CAS Name: N-[(4-hexoxyanilino)-sulfanylidenemethyl]octanamide IUPAC Name: N-[(4-hexoxyphenyl)carbamothioyl]octanamide Traditional Name: N-[(4-hexoxyphenyl)thiocarbamoyl]caprylamide Formula: C21H34N2O2S MolecularWeight: 378.57186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H34N2O2S/c1-3-5-7-9-10-12-20(24)23-21(26)22-18-13-15-19(16-14-18)25-17-11-8-6-4-2/h13-16H,3-12,17H2,1-2H3,(H2,22,23,24,26)