dimethyl-[7-(methylamino)phenothiazin-3-ylidene]azanium sulfate

Systemtic Name: dimethyl-[7-(methylamino)phenothiazin-3-ylidene]azanium sulfate Openeye Name: dimethyl-[7-(methylamino)phenothiazin-3-ylidene]ammonium sulfate CAS Name: dimethyl-[7-(methylamino)-3-phenothiazinylidene]ammonium sulfate IUPAC Name: dimethyl-[7-(methylamino)phenothiazin-3-ylidene]azanium sulfate Traditional Name: dimethyl-[7-(methylamino)phenothiazin-3-ylidene]ammonium sulfate Formula: C30H32N6O4S3 MolecularWeight: 636.80788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C=C3S2.CNC1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C=C3S2.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CNC1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C=C3S2.CNC1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C=C3S2.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/2C15H15N3S.H2O4S/c2*1-16-10-4-6-12-14(8-10)19-15-9-11(18(2)3)5-7-13(15)17-12;1-5(2,3)4/h2*4-9H,1-3H3;(H2,1,2,3,4)