N-[(3,5-dimethoxyphenyl)methyl]-2-(4-nitrophenyl)sulfanyl-ethanamide

Systemtic Name: N-[(3,5-dimethoxyphenyl)methyl]-2-(4-nitrophenyl)sulfanyl-ethanamide Openeye Name: N-[(3,5-dimethoxyphenyl)methyl]-2-(4-nitrophenyl)sulfanyl-acetamide CAS Name: N-[(3,5-dimethoxyphenyl)methyl]-2-[(4-nitrophenyl)thio]acetamide IUPAC Name: N-[(3,5-dimethoxyphenyl)methyl]-2-(4-nitrophenyl)sulfanylacetamide Traditional Name: N-(3,5-dimethoxybenzyl)-2-[(4-nitrophenyl)thio]acetamide Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O5S/c1-23-14-7-12(8-15(9-14)24-2)10-18-17(20)11-25-16-5-3-13(4-6-16)19(21)22/h3-9H,10-11H2,1-2H3,(H,18,20)