N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]-4-imidazol-1-yl-3-nitro-benzamide

Systemtic Name: N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]-4-imidazol-1-yl-3-nitro-benzamide Openeye Name: N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]-4-imidazol-1-yl-3-nitro-benzamide CAS Name: N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]-4-(1-imidazolyl)-3-nitrobenzamide IUPAC Name: N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]-4-imidazol-1-yl-3-nitrobenzamide Traditional Name: N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]-4-imidazol-1-yl-3-nitro-benzamide Formula: C20H21N5O5S MolecularWeight: 443.47624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCNC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCNC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O5S/c1-14-3-4-15(2)19(11-14)31(29,30)23-8-7-22-20(26)16-5-6-17(18(12-16)25(27)28)24-10-9-21-13-24/h3-6,9-13,23H,7-8H2,1-2H3,(H,22,26)