N-[(3-methoxy-4-propoxy-phenyl)methyl]-2-(4-nitrophenyl)sulfanyl-ethanamide

Systemtic Name: N-[(3-methoxy-4-propoxy-phenyl)methyl]-2-(4-nitrophenyl)sulfanyl-ethanamide Openeye Name: N-[(3-methoxy-4-propoxy-phenyl)methyl]-2-(4-nitrophenyl)sulfanyl-acetamide CAS Name: N-[(3-methoxy-4-propoxyphenyl)methyl]-2-[(4-nitrophenyl)thio]acetamide IUPAC Name: N-[(3-methoxy-4-propoxyphenyl)methyl]-2-(4-nitrophenyl)sulfanylacetamide Traditional Name: N-(3-methoxy-4-propoxy-benzyl)-2-[(4-nitrophenyl)thio]acetamide Formula: C19H22N2O5S MolecularWeight: 390.45338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)CNC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)CNC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C19H22N2O5S/c1-3-10-26-17-9-4-14(11-18(17)25-2)12-20-19(22)13-27-16-7-5-15(6-8-16)21(23)24/h4-9,11H,3,10,12-13H2,1-2H3,(H,20,22)