4-(1-ethylbenzimidazol-2-yl)sulfanyl-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-(1-ethylbenzimidazol-2-yl)sulfanyl-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-(1-ethylbenzimidazol-2-yl)sulfanyl-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-[(1-ethyl-2-benzimidazolyl)thio]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-(1-ethylbenzimidazol-2-yl)sulfanyl-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-[(1-ethylbenzimidazol-2-yl)thio]-N-methyl-3-nitro-benzenesulfonamide Formula: C16H16N4O4S2 MolecularWeight: 392.45264

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1SC3=C(C=C(C=C3)S(=O)(=O)NC)[N+](=O)[O-]

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1SC3=C(C=C(C=C3)S(=O)(=O)NC)[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O4S2/c1-3-19-13-7-5-4-6-12(13)18-16(19)25-15-9-8-11(26(23,24)17-2)10-14(15)20(21)22/h4-10,17H,3H2,1-2H3