N,N'-bis[4-(acridin-9-ylamino)phenyl]pentane-1,5-disulfonamide

Systemtic Name: N,N'-bis[4-(acridin-9-ylamino)phenyl]pentane-1,5-disulfonamide Openeye Name: N,N'-bis[4-(acridin-9-ylamino)phenyl]pentane-1,5-disulfonamide CAS Name: N,N'-bis[4-(9-acridinylamino)phenyl]pentane-1,5-disulfonamide IUPAC Name: N,N'-bis[4-(acridin-9-ylamino)phenyl]pentane-1,5-disulfonamide Traditional Name: N,N'-bis[4-(acridin-9-ylamino)phenyl]pentane-1,5-disulfonamide Formula: C43H38N6O4S2 MolecularWeight: 766.92962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC=C(C=C4)NS(=O)(=O)CCCCCS(=O)(=O)NC5=CC=C(C=C5)NC6=C7C=CC=CC7=NC8=CC=CC=C86

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC=C(C=C4)NS(=O)(=O)CCCCCS(=O)(=O)NC5=CC=C(C=C5)NC6=C7C=CC=CC7=NC8=CC=CC=C86

InChI

InChI=1S/C43H38N6O4S2/c50-54(51,48-32-24-20-30(21-25-32)44-42-34-12-2-6-16-38(34)46-39-17-7-3-13-35(39)42)28-10-1-11-29-55(52,53)49-33-26-22-31(23-27-33)45-43-36-14-4-8-18-40(36)47-41-19-9-5-15-37(41)43/h2-9,12-27,48-49H,1,10-11,28-29H2,(H,44,46)(H,45,47)