(2Z)-6-chloranyl-2-[(2E,4E)-5-(6-chloranyl-3-ethyl-1,3-benzothiazol-3-ium-2-yl)penta-2,4-dienylidene]-3-ethyl-1,3-benzothiazole iodide

Systemtic Name: (2Z)-6-chloranyl-2-[(2E,4E)-5-(6-chloranyl-3-ethyl-1,3-benzothiazol-3-ium-2-yl)penta-2,4-dienylidene]-3-ethyl-1,3-benzothiazole iodide Openeye Name: (2Z)-6-chloro-2-[(2E,4E)-5-(6-chloro-3-ethyl-1,3-benzothiazol-3-ium-2-yl)penta-2,4-dienylidene]-3-ethyl-1,3-benzothiazole iodide CAS Name: (2Z)-6-chloro-2-[(2E,4E)-5-(6-chloro-3-ethyl-1,3-benzothiazol-3-ium-2-yl)penta-2,4-dienylidene]-3-ethyl-1,3-benzothiazole iodide IUPAC Name: (2Z)-6-chloro-2-[(2E,4E)-5-(6-chloro-3-ethyl-1,3-benzothiazol-3-ium-2-yl)penta-2,4-dienylidene]-3-ethyl-1,3-benzothiazole iodide Traditional Name: (2Z)-6-chloro-2-[(2E,4E)-5-(6-chloro-3-ethyl-1,3-benzothiazol-3-ium-2-yl)penta-2,4-dienylidene]-3-ethyl-1,3-benzothiazole iodide Formula: C23H21Cl2IN2S2 MolecularWeight: 587.36671

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)Cl)SC1=CC=CC=CC3=[N+](C4=C(S3)C=C(C=C4)Cl)CC.[I-]

Isomeric SMILES

CCN\1C2=C(C=C(C=C2)Cl)S/C1=C\C=C\C=C\C3=[N+](C4=C(S3)C=C(C=C4)Cl)CC.[I-]

InChI

InChI=1S/C23H21Cl2N2S2.HI/c1-3-26-18-12-10-16(24)14-20(18)28-22(26)8-6-5-7-9-23-27(4-2)19-13-11-17(25)15-21(19)29-23;/h5-15H,3-4H2,1-2H3;1H/q+1;/p-1