3-azanyl-N-[2-[3,4-bis(oxidanyl)phenyl]-3-oxidanyl-4-oxidanylidene-chromen-6-yl]-4-(4-methylpiperazin-1-yl)benzenesulfonamide

Systemtic Name: 3-azanyl-N-[2-[3,4-bis(oxidanyl)phenyl]-3-oxidanyl-4-oxidanylidene-chromen-6-yl]-4-(4-methylpiperazin-1-yl)benzenesulfonamide Openeye Name: 3-amino-N-[2-(3,4-dihydroxyphenyl)-3-hydroxy-4-oxo-chromen-6-yl]-4-(4-methylpiperazin-1-yl)benzenesulfonamide CAS Name: 3-amino-N-[2-(3,4-dihydroxyphenyl)-3-hydroxy-4-oxo-1-benzopyran-6-yl]-4-(4-methyl-1-piperazinyl)benzenesulfonamide IUPAC Name: 3-amino-N-[2-(3,4-dihydroxyphenyl)-3-hydroxy-4-oxochromen-6-yl]-4-(4-methylpiperazin-1-yl)benzenesulfonamide Traditional Name: 3-amino-N-[2-(3,4-dihydroxyphenyl)-3-hydroxy-4-keto-chromen-6-yl]-4-(4-methylpiperazino)benzenesulfonamide Formula: C26H26N4O7S MolecularWeight: 538.57224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)NC3=CC4=C(C=C3)OC(=C(C4=O)O)C5=CC(=C(C=C5)O)O)N

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)NC3=CC4=C(C=C3)OC(=C(C4=O)O)C5=CC(=C(C=C5)O)O)N

InChI

InChI=1S/C26H26N4O7S/c1-29-8-10-30(11-9-29)20-5-4-17(14-19(20)27)38(35,36)28-16-3-7-23-18(13-16)24(33)25(34)26(37-23)15-2-6-21(31)22(32)12-15/h2-7,12-14,28,31-32,34H,8-11,27H2,1H3