4-[(4,5-dithiophen-2-yl-1H-imidazol-2-yl)sulfanyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(4,5-dithiophen-2-yl-1H-imidazol-2-yl)sulfanyl]-3-nitro-benzenesulfonamide Openeye Name: 4-[[4,5-bis(2-thienyl)-1H-imidazol-2-yl]sulfanyl]-3-nitro-benzenesulfonamide CAS Name: 4-[(4,5-dithiophen-2-yl-1H-imidazol-2-yl)thio]-3-nitrobenzenesulfonamide IUPAC Name: 4-[(4,5-dithiophen-2-yl-1H-imidazol-2-yl)sulfanyl]-3-nitrobenzenesulfonamide Traditional Name: 4-[[4,5-bis(2-thienyl)-1H-imidazol-2-yl]thio]-3-nitro-benzenesulfonamide Formula: C17H12N4O4S4 MolecularWeight: 464.56158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=C(N=C(N2)SC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-])C4=CC=CS4

Isomeric SMILES

C1=CSC(=C1)C2=C(N=C(N2)SC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-])C4=CC=CS4

InChI

InChI=1S/C17H12N4O4S4/c18-29(24,25)10-5-6-12(11(9-10)21(22)23)28-17-19-15(13-3-1-7-26-13)16(20-17)14-4-2-8-27-14/h1-9H,(H,19,20)(H2,18,24,25)