3-(4-chloranyl-3-ethyl-phenoxy)pentanethioamide

Systemtic Name: 3-(4-chloranyl-3-ethyl-phenoxy)pentanethioamide Openeye Name: 3-(4-chloro-3-ethyl-phenoxy)pentanethioamide CAS Name: 3-(4-chloro-3-ethylphenoxy)pentanethioamide IUPAC Name: 3-(4-chloro-3-ethylphenoxy)pentanethioamide Traditional Name: 3-(4-chloro-3-ethyl-phenoxy)thiovaleramide Formula: C13H18ClNOS MolecularWeight: 271.80612

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)OC(CC)CC(=S)N)Cl

Isomeric SMILES

CCC1=C(C=CC(=C1)OC(CC)CC(=S)N)Cl

InChI

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