N-[(2,6-dimethylphenyl)carbamothioyl]pentanamide

Systemtic Name: N-[(2,6-dimethylphenyl)carbamothioyl]pentanamide Openeye Name: N-[(2,6-dimethylphenyl)carbamothioyl]pentanamide CAS Name: N-[(2,6-dimethylanilino)-sulfanylidenemethyl]pentanamide IUPAC Name: N-[(2,6-dimethylphenyl)carbamothioyl]pentanamide Traditional Name: N-[(2,6-dimethylphenyl)thiocarbamoyl]valeramide Formula: C14H20N2OS MolecularWeight: 264.3864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NC1=C(C=CC=C1C)C

Isomeric SMILES

CCCCC(=O)NC(=S)NC1=C(C=CC=C1C)C

InChI

InChI=1S/C14H20N2OS/c1-4-5-9-12(17)15-14(18)16-13-10(2)7-6-8-11(13)3/h6-8H,4-5,9H2,1-3H3,(H2,15,16,17,18)