N-[9,10-bis(oxidanylidene)anthracen-2-yl]-2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-2-yl]-2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: 2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-N-(9,10-dioxo-2-anthryl)acetamide CAS Name: 2-[(1-butyl-5-sulfamoyl-2-benzimidazolyl)thio]-N-(9,10-dioxo-2-anthracenyl)acetamide IUPAC Name: 2-(1-butyl-5-sulfamoylbenzimidazol-2-yl)sulfanyl-N-(9,10-dioxoanthracen-2-yl)acetamide Traditional Name: 2-[(1-butyl-5-sulfamoyl-benzimidazol-2-yl)thio]-N-(9,10-diketo-2-anthryl)acetamide Formula: C27H24N4O5S2 MolecularWeight: 548.63326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)NC3=CC4=C(C=C3)C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)NC3=CC4=C(C=C3)C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C27H24N4O5S2/c1-2-3-12-31-23-11-9-17(38(28,35)36)14-22(23)30-27(31)37-15-24(32)29-16-8-10-20-21(13-16)26(34)19-7-5-4-6-18(19)25(20)33/h4-11,13-14H,2-3,12,15H2,1H3,(H,29,32)(H2,28,35,36)