6-[dimethyl(2-phenothiazin-10-ylethyl)azaniumyl]hexyl-dimethyl-(2-phenothiazin-10-ylethyl)azanium dibromide

Systemtic Name: 6-[dimethyl(2-phenothiazin-10-ylethyl)azaniumyl]hexyl-dimethyl-(2-phenothiazin-10-ylethyl)azanium dibromide Openeye Name: 6-[dimethyl(2-phenothiazin-10-ylethyl)ammonio]hexyl-dimethyl-(2-phenothiazin-10-ylethyl)ammonium dibromide CAS Name: 6-[dimethyl-[2-(10-phenothiazinyl)ethyl]ammonio]hexyl-dimethyl-[2-(10-phenothiazinyl)ethyl]ammonium dibromide IUPAC Name: 6-[dimethyl(2-phenothiazin-10-ylethyl)azaniumyl]hexyl-dimethyl-(2-phenothiazin-10-ylethyl)azanium dibromide Traditional Name: 6-[dimethyl(2-phenothiazin-10-ylethyl)ammonio]hexyl-dimethyl-(2-phenothiazin-10-ylethyl)ammonium dibromide Formula: C38H48Br2N4S2 MolecularWeight: 784.75252

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCCCCC[N+](C)(C)CCN1C2=CC=CC=C2SC3=CC=CC=C31)CCN4C5=CC=CC=C5SC6=CC=CC=C64.[Br-].[Br-]

Isomeric SMILES

C[N+](C)(CCCCCC[N+](C)(C)CCN1C2=CC=CC=C2SC3=CC=CC=C31)CCN4C5=CC=CC=C5SC6=CC=CC=C64.[Br-].[Br-]

InChI

InChI=1S/C38H48N4S2.2BrH/c1-41(2,29-25-39-31-17-7-11-21-35(31)43-36-22-12-8-18-32(36)39)27-15-5-6-16-28-42(3,4)30-26-40-33-19-9-13-23-37(33)44-38-24-14-10-20-34(38)40;;/h7-14,17-24H,5-6,15-16,25-30H2,1-4H3;2*1H/q+2;;/p-2