N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-2-(4-nitroimidazol-1-yl)ethanamide

Systemtic Name: N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-2-(4-nitroimidazol-1-yl)ethanamide Openeye Name: N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-2-(4-nitroimidazol-1-yl)acetamide CAS Name: N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(4-nitro-1-imidazolyl)acetamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(4-nitroimidazol-1-yl)acetamide Traditional Name: N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-2-(4-nitroimidazol-1-yl)acetamide Formula: C16H21N5O6S MolecularWeight: 411.43284

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=O)CN2C=C(N=C2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=O)CN2C=C(N=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H21N5O6S/c1-4-20(5-2)28(25,26)12-6-7-14(27-3)13(8-12)18-16(22)10-19-9-15(17-11-19)21(23)24/h6-9,11H,4-5,10H2,1-3H3,(H,18,22)