3-(2-tert-butyl-4-methoxy-phenoxy)propanethioamide

Systemtic Name: 3-(2-tert-butyl-4-methoxy-phenoxy)propanethioamide Openeye Name: 3-(2-tert-butyl-4-methoxy-phenoxy)propanethioamide CAS Name: 3-(2-tert-butyl-4-methoxyphenoxy)propanethioamide IUPAC Name: 3-(2-tert-butyl-4-methoxyphenoxy)propanethioamide Traditional Name: 3-(2-tert-butyl-4-methoxy-phenoxy)thiopropionamide Formula: C14H21NO2S MolecularWeight: 267.38704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)OC)OCCC(=S)N

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)OC)OCCC(=S)N

InChI

InChI=1S/C14H21NO2S/c1-14(2,3)11-9-10(16-4)5-6-12(11)17-8-7-13(15)18/h5-6,9H,7-8H2,1-4H3,(H2,15,18)