[4-methyl-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1,3,4-thiadiazolidin-2-ylidene]-phenyl-azanium chloride

Systemtic Name: [4-methyl-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1,3,4-thiadiazolidin-2-ylidene]-phenyl-azanium chloride Openeye Name: [4-methyl-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,3,4-thiadiazolidin-2-ylidene]-phenyl-ammonium chloride CAS Name: [4-methyl-5-(4-oxo-1-cyclohexa-2,5-dienylidene)-1,3,4-thiadiazolidin-2-ylidene]-phenylammonium chloride IUPAC Name: [4-methyl-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,3,4-thiadiazolidin-2-ylidene]-phenylazanium chloride Traditional Name: [5-(4-ketocyclohexa-2,5-dien-1-ylidene)-4-methyl-1,3,4-thiadiazolidin-2-ylidene]-phenyl-ammonium chloride Formula: C15H14ClN3OS MolecularWeight: 319.80916

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C2C=CC(=O)C=C2)SC(=[NH+]C3=CC=CC=C3)N1.[Cl-]

Isomeric SMILES

CN1C(=C2C=CC(=O)C=C2)SC(=[NH+]C3=CC=CC=C3)N1.[Cl-]

InChI

InChI=1S/C15H13N3OS.ClH/c1-18-14(11-7-9-13(19)10-8-11)20-15(17-18)16-12-5-3-2-4-6-12;/h2-10H,1H3,(H,16,17);1H