N-(2,5-dimethylphenyl)-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanamide Openeye Name: N-(2,5-dimethylphenyl)-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]acetamide CAS Name: N-(2,5-dimethylphenyl)-2-[(4-methoxy-3-nitrophenyl)methylthio]acetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-[(4-methoxy-3-nitrophenyl)methylsulfanyl]acetamide Traditional Name: N-(2,5-dimethylphenyl)-2-[(4-methoxy-3-nitro-benzyl)thio]acetamide Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CSCC2=CC(=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CSCC2=CC(=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O4S/c1-12-4-5-13(2)15(8-12)19-18(21)11-25-10-14-6-7-17(24-3)16(9-14)20(22)23/h4-9H,10-11H2,1-3H3,(H,19,21)