N-[2-[(3-methyl-5-nitro-imidazol-4-yl)amino]ethyl]-1-phenyl-methanesulfonamide

Systemtic Name: N-[2-[(3-methyl-5-nitro-imidazol-4-yl)amino]ethyl]-1-phenyl-methanesulfonamide Openeye Name: N-[2-[(3-methyl-5-nitro-imidazol-4-yl)amino]ethyl]-1-phenyl-methanesulfonamide CAS Name: N-[2-[(3-methyl-5-nitro-4-imidazolyl)amino]ethyl]-1-phenylmethanesulfonamide IUPAC Name: N-[2-[(3-methyl-5-nitroimidazol-4-yl)amino]ethyl]-1-phenylmethanesulfonamide Traditional Name: N-[2-[(3-methyl-5-nitro-imidazol-4-yl)amino]ethyl]-1-phenyl-methanesulfonamide Formula: C13H17N5O4S MolecularWeight: 339.37018

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1NCCNS(=O)(=O)CC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1NCCNS(=O)(=O)CC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H17N5O4S/c1-17-10-15-13(18(19)20)12(17)14-7-8-16-23(21,22)9-11-5-3-2-4-6-11/h2-6,10,14,16H,7-9H2,1H3