(2Z)-2-[(2Z,4E)-3,5-bis(3-ethyl-5-methyl-1,3,4-thiadiazol-3-ium-2-yl)penta-2,4-dienylidene]-3-ethyl-5-methyl-1,3,4-thiadiazole diiodide

Systemtic Name: (2Z)-2-[(2Z,4E)-3,5-bis(3-ethyl-5-methyl-1,3,4-thiadiazol-3-ium-2-yl)penta-2,4-dienylidene]-3-ethyl-5-methyl-1,3,4-thiadiazole diiodide Openeye Name: (2Z)-2-[(2Z,4E)-3,5-bis(3-ethyl-5-methyl-1,3,4-thiadiazol-3-ium-2-yl)penta-2,4-dienylidene]-3-ethyl-5-methyl-1,3,4-thiadiazole diiodide CAS Name: (2Z)-2-[(2Z,4E)-3,5-bis(3-ethyl-5-methyl-1,3,4-thiadiazol-3-ium-2-yl)penta-2,4-dienylidene]-3-ethyl-5-methyl-1,3,4-thiadiazole diiodide IUPAC Name: (2Z)-2-[(2Z,4E)-3,5-bis(3-ethyl-5-methyl-1,3,4-thiadiazol-3-ium-2-yl)penta-2,4-dienylidene]-3-ethyl-5-methyl-1,3,4-thiadiazole diiodide Traditional Name: (2Z)-2-[(2Z,4E)-3,5-bis(3-ethyl-5-methyl-1,3,4-thiadiazol-3-ium-2-yl)penta-2,4-dienylidene]-3-ethyl-5-methyl-1,3,4-thiadiazole diiodide Formula: C20H28I2N6S3 MolecularWeight: 702.48046

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=C(C=CC2=[N+](N=C(S2)C)CC)C3=[N+](N=C(S3)C)CC)SC(=N1)C.[I-].[I-]

Isomeric SMILES

CCN1/C(=C/C=C(/C=C/C2=[N+](N=C(S2)C)CC)\C3=[N+](N=C(S3)C)CC)/SC(=N1)C.[I-].[I-]

InChI

InChI=1S/C20H28N6S3.2HI/c1-7-24-18(27-14(4)21-24)12-10-17(20-26(9-3)23-16(6)29-20)11-13-19-25(8-2)22-15(5)28-19;;/h10-13H,7-9H2,1-6H3;2*1H/q+2;;/p-2