N,N-dimethyl-2-[(4-nitroimidazol-1-yl)methyl]-1-propyl-benzimidazole-5-sulfonamide

Systemtic Name: N,N-dimethyl-2-[(4-nitroimidazol-1-yl)methyl]-1-propyl-benzimidazole-5-sulfonamide Openeye Name: N,N-dimethyl-2-[(4-nitroimidazol-1-yl)methyl]-1-propyl-benzimidazole-5-sulfonamide CAS Name: N,N-dimethyl-2-[(4-nitro-1-imidazolyl)methyl]-1-propyl-5-benzimidazolesulfonamide IUPAC Name: N,N-dimethyl-2-[(4-nitroimidazol-1-yl)methyl]-1-propylbenzimidazole-5-sulfonamide Traditional Name: N,N-dimethyl-2-[(4-nitroimidazol-1-yl)methyl]-1-propyl-benzimidazole-5-sulfonamide Formula: C16H20N6O4S MolecularWeight: 392.4328

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CN3C=C(N=C3)[N+](=O)[O-]

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CN3C=C(N=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H20N6O4S/c1-4-7-21-14-6-5-12(27(25,26)19(2)3)8-13(14)18-16(21)10-20-9-15(17-11-20)22(23)24/h5-6,8-9,11H,4,7,10H2,1-3H3