S-[6-(3-methylphenoxy)hexyl] N,N-dimethylcarbamothioate

Systemtic Name: S-[6-(3-methylphenoxy)hexyl] N,N-dimethylcarbamothioate Openeye Name: S-[6-(3-methylphenoxy)hexyl] N,N-dimethylcarbamothioate CAS Name: N,N-dimethylcarbamothioic acid S-[6-(3-methylphenoxy)hexyl] ester IUPAC Name: S-[6-(3-methylphenoxy)hexyl] N,N-dimethylcarbamothioate Traditional Name: N,N-dimethylthiocarbamic acid S-[6-(3-methylphenoxy)hexyl] ester Formula: C16H25NO2S MolecularWeight: 295.4402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCCCCSC(=O)N(C)C

Isomeric SMILES

CC1=CC(=CC=C1)OCCCCCCSC(=O)N(C)C

InChI

InChI=1S/C16H25NO2S/c1-14-9-8-10-15(13-14)19-11-6-4-5-7-12-20-16(18)17(2)3/h8-10,13H,4-7,11-12H2,1-3H3