[7-[bis(2-methylpropyl)amino]phenothiazin-3-ylidene]-bis(2-methylpropyl)azanium

Systemtic Name: [7-[bis(2-methylpropyl)amino]phenothiazin-3-ylidene]-bis(2-methylpropyl)azanium Openeye Name: [7-(diisobutylamino)phenothiazin-3-ylidene]-diisobutyl-ammonium CAS Name: [7-[bis(2-methylpropyl)amino]-3-phenothiazinylidene]-bis(2-methylpropyl)ammonium IUPAC Name: [7-[bis(2-methylpropyl)amino]phenothiazin-3-ylidene]-bis(2-methylpropyl)azanium Traditional Name: [7-(diisobutylamino)phenothiazin-3-ylidene]-diisobutyl-ammonium Formula: C28H42N3S+ MolecularWeight: 452.71818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C1=CC2=C(C=C1)N=C3C=CC(=[N+](CC(C)C)CC(C)C)C=C3S2

Isomeric SMILES

CC(C)CN(CC(C)C)C1=CC2=C(C=C1)N=C3C=CC(=[N+](CC(C)C)CC(C)C)C=C3S2

InChI

InChI=1S/C28H42N3S/c1-19(2)15-30(16-20(3)4)23-9-11-25-27(13-23)32-28-14-24(10-12-26(28)29-25)31(17-21(5)6)18-22(7)8/h9-14,19-22H,15-18H2,1-8H3/q+1