4-(4-chloranyl-2,6-dimethyl-phenoxy)butanethioamide

Systemtic Name: 4-(4-chloranyl-2,6-dimethyl-phenoxy)butanethioamide Openeye Name: 4-(4-chloro-2,6-dimethyl-phenoxy)butanethioamide CAS Name: 4-(4-chloro-2,6-dimethylphenoxy)butanethioamide IUPAC Name: 4-(4-chloro-2,6-dimethylphenoxy)butanethioamide Traditional Name: 4-(4-chloro-2,6-dimethyl-phenoxy)thiobutyramide Formula: C12H16ClNOS MolecularWeight: 257.77954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCCC(=S)N)C)Cl

Isomeric SMILES

CC1=CC(=CC(=C1OCCCC(=S)N)C)Cl

InChI

InChI=1S/C12H16ClNOS/c1-8-6-10(13)7-9(2)12(8)15-5-3-4-11(14)16/h6-7H,3-5H2,1-2H3,(H2,14,16)