N-[(3,4-dimethylphenyl)carbamothioyl]dodecanamide

Systemtic Name: N-[(3,4-dimethylphenyl)carbamothioyl]dodecanamide Openeye Name: N-[(3,4-dimethylphenyl)carbamothioyl]dodecanamide CAS Name: N-[(3,4-dimethylanilino)-sulfanylidenemethyl]dodecanamide IUPAC Name: N-[(3,4-dimethylphenyl)carbamothioyl]dodecanamide Traditional Name: N-[(3,4-dimethylphenyl)thiocarbamoyl]lauramide Formula: C21H34N2OS MolecularWeight: 362.57246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H34N2OS/c1-4-5-6-7-8-9-10-11-12-13-20(24)23-21(25)22-19-15-14-17(2)18(3)16-19/h14-16H,4-13H2,1-3H3,(H2,22,23,24,25)