(7-azanyl-4-butyl-phenothiazin-3-ylidene)azanium chloride

Systemtic Name: (7-azanyl-4-butyl-phenothiazin-3-ylidene)azanium chloride Openeye Name: (7-amino-4-butyl-phenothiazin-3-ylidene)ammonium chloride CAS Name: (7-amino-4-butyl-3-phenothiazinylidene)ammonium chloride IUPAC Name: (7-amino-4-butylphenothiazin-3-ylidene)azanium chloride Traditional Name: (7-amino-4-butyl-phenothiazin-3-ylidene)ammonium chloride Formula: C16H18ClN3S MolecularWeight: 319.85222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C(=NC3=C(S2)C=C(C=C3)N)C=CC1=[NH2+].[Cl-]

Isomeric SMILES

CCCCC1=C2C(=NC3=C(S2)C=C(C=C3)N)C=CC1=[NH2+].[Cl-]

InChI

InChI=1S/C16H17N3S.ClH/c1-2-3-4-11-12(18)6-8-14-16(11)20-15-9-10(17)5-7-13(15)19-14;/h5-9,18H,2-4,17H2,1H3;1H