4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-N-phenyl-benzenesulfonamide

Systemtic Name: 4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-N-phenyl-benzenesulfonamide Openeye Name: 4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-N-phenyl-benzenesulfonamide CAS Name: 4-[(1-methyl-2-imidazolyl)thio]-3-nitro-N-phenylbenzenesulfonamide IUPAC Name: 4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-N-phenylbenzenesulfonamide Traditional Name: 4-[(1-methylimidazol-2-yl)thio]-3-nitro-N-phenyl-benzenesulfonamide Formula: C16H14N4O4S2 MolecularWeight: 390.43676

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C=CN=C1SC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O4S2/c1-19-10-9-17-16(19)25-15-8-7-13(11-14(15)20(21)22)26(23,24)18-12-5-3-2-4-6-12/h2-11,18H,1H3