N,N-dipropyl-7-thiomorpholin-4-ium-4-ylidene-phenoxazin-3-amine chloride

Systemtic Name: N,N-dipropyl-7-thiomorpholin-4-ium-4-ylidene-phenoxazin-3-amine chloride Openeye Name: N,N-dipropyl-7-thiomorpholin-4-ium-4-ylidene-phenoxazin-3-amine chloride CAS Name: N,N-dipropyl-7-(4-thiomorpholin-4-iumylidene)-3-phenoxazinamine chloride IUPAC Name: N,N-dipropyl-7-thiomorpholin-4-ium-4-ylidenephenoxazin-3-amine chloride Traditional Name: dipropyl-(7-thiomorpholin-4-ium-4-ylidenephenoxazin-3-yl)amine chloride Formula: C22H28ClN3OS MolecularWeight: 417.99522

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=CC2=C(C=C1)N=C3C=CC(=[N+]4CCSCC4)C=C3O2.[Cl-]

Isomeric SMILES

CCCN(CCC)C1=CC2=C(C=C1)N=C3C=CC(=[N+]4CCSCC4)C=C3O2.[Cl-]

InChI

InChI=1S/C22H28N3OS.ClH/c1-3-9-24(10-4-2)17-5-7-19-21(15-17)26-22-16-18(6-8-20(22)23-19)25-11-13-27-14-12-25;/h5-8,15-16H,3-4,9-14H2,1-2H3;1H/q+1;/p-1