N1,N6-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]naphthalene-1,6-disulfonamide chloride

Systemtic Name: N1,N6-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]naphthalene-1,6-disulfonamide chloride Openeye Name: N1,N6-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]naphthalene-1,6-disulfonamide chloride CAS Name: N1,N6-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]naphthalene-1,6-disulfonamide chloride IUPAC Name: 1-N,6-N-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]naphthalene-1,6-disulfonamide chloride Traditional Name: N,N'-bis[3-(2-imidazolin-2-yl)phenyl]naphthalene-1,6-disulfonamide chloride Formula: C28H26ClN6O4S2- MolecularWeight: 610.12684

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(N1)C2=CC(=CC=C2)NS(=O)(=O)C3=CC4=C(C=C3)C(=CC=C4)S(=O)(=O)NC5=CC=CC(=C5)C6=NCCN6.[Cl-]

Isomeric SMILES

C1CN=C(N1)C2=CC(=CC=C2)NS(=O)(=O)C3=CC4=C(C=C3)C(=CC=C4)S(=O)(=O)NC5=CC=CC(=C5)C6=NCCN6.[Cl-]

InChI

InChI=1S/C28H26N6O4S2.ClH/c35-39(36,33-22-7-1-5-20(16-22)27-29-12-13-30-27)24-10-11-25-19(18-24)4-3-9-26(25)40(37,38)34-23-8-2-6-21(17-23)28-31-14-15-32-28;/h1-11,16-18,33-34H,12-15H2,(H,29,30)(H,31,32);1H/p-1