4,6-dimethoxy-N1,N3-bis(3-phenothiazin-10-ylcarbonylphenyl)benzene-1,3-disulfonamide

Systemtic Name: 4,6-dimethoxy-N1,N3-bis(3-phenothiazin-10-ylcarbonylphenyl)benzene-1,3-disulfonamide Openeye Name: 4,6-dimethoxy-N1,N3-bis[3-(phenothiazine-10-carbonyl)phenyl]benzene-1,3-disulfonamide CAS Name: 4,6-dimethoxy-N1,N3-bis[3-[oxo(10-phenothiazinyl)methyl]phenyl]benzene-1,3-disulfonamide IUPAC Name: 4,6-dimethoxy-1-N,3-N-bis[3-(phenothiazine-10-carbonyl)phenyl]benzene-1,3-disulfonamide Traditional Name: 4,6-dimethoxy-N,N'-bis[3-(phenothiazine-10-carbonyl)phenyl]benzene-1,3-disulfonamide Formula: C46H34N4O8S4 MolecularWeight: 899.04416

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1S(=O)(=O)NC2=CC=CC(=C2)C(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)S(=O)(=O)NC6=CC=CC(=C6)C(=O)N7C8=CC=CC=C8SC9=CC=CC=C97)OC

Isomeric SMILES

COC1=CC(=C(C=C1S(=O)(=O)NC2=CC=CC(=C2)C(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)S(=O)(=O)NC6=CC=CC(=C6)C(=O)N7C8=CC=CC=C8SC9=CC=CC=C97)OC

InChI

InChI=1S/C46H34N4O8S4/c1-57-37-27-38(58-2)44(62(55,56)48-32-16-12-14-30(26-32)46(52)50-35-19-5-9-23-41(35)60-42-24-10-6-20-36(42)50)28-43(37)61(53,54)47-31-15-11-13-29(25-31)45(51)49-33-17-3-7-21-39(33)59-40-22-8-4-18-34(40)49/h3-28,47-48H,1-2H3