N-[8-azanyl-7-bromanyl-5-[(4-methylphenyl)sulfonylamino]-9,10-bis(oxidanylidene)anthracen-1-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[8-azanyl-7-bromanyl-5-[(4-methylphenyl)sulfonylamino]-9,10-bis(oxidanylidene)anthracen-1-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[8-amino-7-bromo-9,10-dioxo-5-(p-tolylsulfonylamino)-1-anthryl]-4-methyl-benzenesulfonamide CAS Name: N-[8-amino-7-bromo-5-[(4-methylphenyl)sulfonylamino]-9,10-dioxo-1-anthracenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[8-amino-7-bromo-5-[(4-methylphenyl)sulfonylamino]-9,10-dioxoanthracen-1-yl]-4-methylbenzenesulfonamide Traditional Name: N-[8-amino-7-bromo-9,10-diketo-5-(tosylamino)-1-anthryl]-4-methyl-benzenesulfonamide Formula: C28H22BrN3O6S2 MolecularWeight: 640.52478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC(=C4N)Br)NS(=O)(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC(=C4N)Br)NS(=O)(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C28H22BrN3O6S2/c1-15-6-10-17(11-7-15)39(35,36)31-21-5-3-4-19-23(21)28(34)25-24(27(19)33)22(14-20(29)26(25)30)32-40(37,38)18-12-8-16(2)9-13-18/h3-14,31-32H,30H2,1-2H3