dimethyl-[(1S)-2-[(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)azaniumyl]-1-phenyl-ethyl]azanium

Systemtic Name: dimethyl-[(1S)-2-[(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)azaniumyl]-1-phenyl-ethyl]azanium Openeye Name: dimethyl-[(1S)-2-[(2-oxo-2-phenothiazin-10-yl-ethyl)ammonio]-1-phenyl-ethyl]ammonium CAS Name: dimethyl-[(1S)-2-[[2-oxo-2-(10-phenothiazinyl)ethyl]ammonio]-1-phenylethyl]ammonium IUPAC Name: dimethyl-[(1S)-2-[(2-oxo-2-phenothiazin-10-ylethyl)azaniumyl]-1-phenylethyl]azanium Traditional Name: [(1S)-2-[(2-keto-2-phenothiazin-10-yl-ethyl)ammonio]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C24H27N3OS+2 MolecularWeight: 405.55568

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(C[NH2+]CC(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)C4=CC=CC=C4

Isomeric SMILES

C[NH+](C)[C@H](C[NH2+]CC(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)C4=CC=CC=C4

InChI

InChI=1S/C24H25N3OS/c1-26(2)21(18-10-4-3-5-11-18)16-25-17-24(28)27-19-12-6-8-14-22(19)29-23-15-9-7-13-20(23)27/h3-15,21,25H,16-17H2,1-2H3/p+2/t21-/m1/s1