N-[(4-acetamidophenyl)carbamothioyl]octanamide

Systemtic Name: N-[(4-acetamidophenyl)carbamothioyl]octanamide Openeye Name: N-[(4-acetamidophenyl)carbamothioyl]octanamide CAS Name: N-[(4-acetamidoanilino)-sulfanylidenemethyl]octanamide IUPAC Name: N-[(4-acetamidophenyl)carbamothioyl]octanamide Traditional Name: N-[(4-acetamidophenyl)thiocarbamoyl]caprylamide Formula: C17H25N3O2S MolecularWeight: 335.4643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N3O2S/c1-3-4-5-6-7-8-16(22)20-17(23)19-15-11-9-14(10-12-15)18-13(2)21/h9-12H,3-8H2,1-2H3,(H,18,21)(H2,19,20,22,23)