5-methyl-4-(7-methyl-4H-1,4-benzothiazin-3-yl)-3-phenyl-1H-imidazol-3-ium-2-thiol

Systemtic Name: 5-methyl-4-(7-methyl-4H-1,4-benzothiazin-3-yl)-3-phenyl-1H-imidazol-3-ium-2-thiol Openeye Name: 5-methyl-4-(7-methyl-4H-1,4-benzothiazin-3-yl)-3-phenyl-1H-imidazol-3-ium-2-thiol CAS Name: 5-methyl-4-(7-methyl-4H-1,4-benzothiazin-3-yl)-3-phenyl-1H-imidazol-3-ium-2-thiol IUPAC Name: 5-methyl-4-(7-methyl-4H-1,4-benzothiazin-3-yl)-3-phenyl-1H-imidazol-3-ium-2-thiol Traditional Name: 5-methyl-4-(7-methyl-4H-1,4-benzothiazin-3-yl)-3-phenyl-1H-imidazol-3-ium-2-thiol Formula: C19H18N3S2+ MolecularWeight: 352.49632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=CS2)C3=C(NC(=[N+]3C4=CC=CC=C4)S)C

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=CS2)C3=C(NC(=[N+]3C4=CC=CC=C4)S)C

InChI

InChI=1S/C19H17N3S2/c1-12-8-9-15-17(10-12)24-11-16(21-15)18-13(2)20-19(23)22(18)14-6-4-3-5-7-14/h3-11,21H,1-2H3,(H,20,23)/p+1