[7-(diethylamino)phenothiazin-3-ylidene]-diethyl-azanium dichloride

Systemtic Name: [7-(diethylamino)phenothiazin-3-ylidene]-diethyl-azanium dichloride Openeye Name: [7-(diethylamino)phenothiazin-3-ylidene]-diethyl-ammonium dichloride CAS Name: [7-(diethylamino)-3-phenothiazinylidene]-diethylammonium dichloride IUPAC Name: [7-(diethylamino)phenothiazin-3-ylidene]-diethylazanium dichloride Traditional Name: [7-(diethylamino)phenothiazin-3-ylidene]-diethyl-ammonium dichloride Formula: C40H52Cl2N6S2 MolecularWeight: 751.91708

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)N=C3C=CC(=[N+](CC)CC)C=C3S2.CCN(CC)C1=CC2=C(C=C1)N=C3C=CC(=[N+](CC)CC)C=C3S2.[Cl-].[Cl-]

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)N=C3C=CC(=[N+](CC)CC)C=C3S2.CCN(CC)C1=CC2=C(C=C1)N=C3C=CC(=[N+](CC)CC)C=C3S2.[Cl-].[Cl-]

InChI

InChI=1S/2C20H26N3S.2ClH/c2*1-5-22(6-2)15-9-11-17-19(13-15)24-20-14-16(23(7-3)8-4)10-12-18(20)21-17;;/h2*9-14H,5-8H2,1-4H3;2*1H/q2*+1;;/p-2