4-(2,3,5-trimethylphenoxy)butanethioamide

Systemtic Name: 4-(2,3,5-trimethylphenoxy)butanethioamide Openeye Name: 4-(2,3,5-trimethylphenoxy)butanethioamide CAS Name: 4-(2,3,5-trimethylphenoxy)butanethioamide IUPAC Name: 4-(2,3,5-trimethylphenoxy)butanethioamide Traditional Name: 4-(2,3,5-trimethylphenoxy)thiobutyramide Formula: C13H19NOS MolecularWeight: 237.36106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCCCC(=S)N)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OCCCC(=S)N)C)C

InChI

InChI=1S/C13H19NOS/c1-9-7-10(2)11(3)12(8-9)15-6-4-5-13(14)16/h7-8H,4-6H2,1-3H3,(H2,14,16)