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

Systemtic Name: 2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-N-(2-methyl-5-nitro-phenyl)ethanamide Openeye Name: 2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-N-(2-methyl-5-nitro-phenyl)acetamide CAS Name: 2-[(4-methoxy-3-nitrophenyl)methylthio]-N-(2-methyl-5-nitrophenyl)acetamide IUPAC Name: 2-[(4-methoxy-3-nitrophenyl)methylsulfanyl]-N-(2-methyl-5-nitrophenyl)acetamide Traditional Name: 2-[(4-methoxy-3-nitro-benzyl)thio]-N-(2-methyl-5-nitro-phenyl)acetamide Formula: C17H17N3O6S MolecularWeight: 391.39838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O6S/c1-11-3-5-13(19(22)23)8-14(11)18-17(21)10-27-9-12-4-6-16(26-2)15(7-12)20(24)25/h3-8H,9-10H2,1-2H3,(H,18,21)