N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-nitrophenyl)sulfanyl-ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-nitrophenyl)sulfanyl-ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-nitrophenyl)sulfanyl-acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-nitrophenyl)thio]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-nitrophenyl)sulfanylacetamide Traditional Name: N-homoveratryl-2-[(4-nitrophenyl)thio]acetamide Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C18H20N2O5S/c1-24-16-8-3-13(11-17(16)25-2)9-10-19-18(21)12-26-15-6-4-14(5-7-15)20(22)23/h3-8,11H,9-10,12H2,1-2H3,(H,19,21)