N-[(2,4,6-trimethylphenyl)carbamothioyl]octanamide

Systemtic Name: N-[(2,4,6-trimethylphenyl)carbamothioyl]octanamide Openeye Name: N-[(2,4,6-trimethylphenyl)carbamothioyl]octanamide CAS Name: N-[sulfanylidene-(2,4,6-trimethylanilino)methyl]octanamide IUPAC Name: N-[(2,4,6-trimethylphenyl)carbamothioyl]octanamide Traditional Name: N-(mesitylthiocarbamoyl)caprylamide Formula: C18H28N2OS MolecularWeight: 320.49272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NC1=C(C=C(C=C1C)C)C

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NC1=C(C=C(C=C1C)C)C

InChI

InChI=1S/C18H28N2OS/c1-5-6-7-8-9-10-16(21)19-18(22)20-17-14(3)11-13(2)12-15(17)4/h11-12H,5-10H2,1-4H3,(H2,19,20,21,22)