N-[1-(1-benzofuran-2-yl)ethyl]-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanamide

Systemtic Name: N-[1-(1-benzofuran-2-yl)ethyl]-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanamide Openeye Name: N-[1-(benzofuran-2-yl)ethyl]-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]acetamide CAS Name: N-[1-(2-benzofuranyl)ethyl]-2-[(4-methoxy-3-nitrophenyl)methylthio]acetamide IUPAC Name: N-[1-(1-benzofuran-2-yl)ethyl]-2-[(4-methoxy-3-nitrophenyl)methylsulfanyl]acetamide Traditional Name: N-[1-(benzofuran-2-yl)ethyl]-2-[(4-methoxy-3-nitro-benzyl)thio]acetamide Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2O1)NC(=O)CSCC3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC2=CC=CC=C2O1)NC(=O)CSCC3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H20N2O5S/c1-13(19-10-15-5-3-4-6-17(15)27-19)21-20(23)12-28-11-14-7-8-18(26-2)16(9-14)22(24)25/h3-10,13H,11-12H2,1-2H3,(H,21,23)