N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-2-phenyl-ethanethioamide

Systemtic Name: N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-2-phenyl-ethanethioamide Openeye Name: N-[(E)-(3,4-dimethoxyphenyl)methyleneamino]-2-phenyl-thioacetamide CAS Name: N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-2-phenylethanethioamide IUPAC Name: N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-2-phenylethanethioamide Traditional Name: 2-phenyl-N-[(E)-veratrylideneamino]thioacetamide Formula: C17H18N2O2S MolecularWeight: 314.40202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=S)CC2=CC=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=S)CC2=CC=CC=C2)OC

InChI

InChI=1S/C17H18N2O2S/c1-20-15-9-8-14(10-16(15)21-2)12-18-19-17(22)11-13-6-4-3-5-7-13/h3-10,12H,11H2,1-2H3,(H,19,22)/b18-12+