3-(4-chloranyl-3,5-dimethyl-phenoxy)pentanethioamide

Systemtic Name: 3-(4-chloranyl-3,5-dimethyl-phenoxy)pentanethioamide Openeye Name: 3-(4-chloro-3,5-dimethyl-phenoxy)pentanethioamide CAS Name: 3-(4-chloro-3,5-dimethylphenoxy)pentanethioamide IUPAC Name: 3-(4-chloro-3,5-dimethylphenoxy)pentanethioamide Traditional Name: 3-(4-chloro-3,5-dimethyl-phenoxy)thiovaleramide Formula: C13H18ClNOS MolecularWeight: 271.80612

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=S)N)OC1=CC(=C(C(=C1)C)Cl)C

Isomeric SMILES

CCC(CC(=S)N)OC1=CC(=C(C(=C1)C)Cl)C

InChI

InChI=1S/C13H18ClNOS/c1-4-10(7-12(15)17)16-11-5-8(2)13(14)9(3)6-11/h5-6,10H,4,7H2,1-3H3,(H2,15,17)