N-[5-(diethylsulfamoyl)-2,3-dimethyl-phenyl]-3-[(2-nitrophenyl)amino]propanamide

Systemtic Name: N-[5-(diethylsulfamoyl)-2,3-dimethyl-phenyl]-3-[(2-nitrophenyl)amino]propanamide Openeye Name: N-[5-(diethylsulfamoyl)-2,3-dimethyl-phenyl]-3-(2-nitroanilino)propanamide CAS Name: N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-3-(2-nitroanilino)propanamide IUPAC Name: N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-3-(2-nitroanilino)propanamide Traditional Name: N-[5-(diethylsulfamoyl)-2,3-dimethyl-phenyl]-3-(2-nitroanilino)propionamide Formula: C21H28N4O5S MolecularWeight: 448.53582

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C(=C1)C)C)NC(=O)CCNC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C(=C1)C)C)NC(=O)CCNC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C21H28N4O5S/c1-5-24(6-2)31(29,30)17-13-15(3)16(4)19(14-17)23-21(26)11-12-22-18-9-7-8-10-20(18)25(27)28/h7-10,13-14,22H,5-6,11-12H2,1-4H3,(H,23,26)