S-(3-oxidanyl-4-propyl-phenyl) N,N-dimethylcarbamothioate

Systemtic Name: S-(3-oxidanyl-4-propyl-phenyl) N,N-dimethylcarbamothioate Openeye Name: S-(3-hydroxy-4-propyl-phenyl) N,N-dimethylcarbamothioate CAS Name: N,N-dimethylcarbamothioic acid S-(3-hydroxy-4-propylphenyl) ester IUPAC Name: S-(3-hydroxy-4-propylphenyl) N,N-dimethylcarbamothioate Traditional Name: N,N-dimethylthiocarbamic acid S-(3-hydroxy-4-propyl-phenyl) ester Formula: C12H17NO2S MolecularWeight: 239.33388

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(C=C1)SC(=O)N(C)C)O

Isomeric SMILES

CCCC1=C(C=C(C=C1)SC(=O)N(C)C)O

InChI

InChI=1S/C12H17NO2S/c1-4-5-9-6-7-10(8-11(9)14)16-12(15)13(2)3/h6-8,14H,4-5H2,1-3H3