Identification
Name |
3,3'-Dipentylthiacarbocyanine Iodide |
Synonyms |
3-Pentyl-2-[(E,3Z)-3-(3-Pentyl-1,3-Benzothiazol-2-Ylidene)Prop-1-Enyl]-1,3-Benzothiazol-3-Ium Iodide; 3-Amyl-2-[(E,3Z)-3-(3-Amyl-1,3-Benzothiazol-2-Ylidene)Prop-1-Enyl]-1,3-Benzothiazol-3-Ium Iodide; 3-Amyl-2-[3-(3-Amyl-1,3-Benzothiazol-2-Ylidene)Prop-1-Enyl]-1,3-Benzothiazol-3-Ium Iodide |
|
Molecular Structure |
 |
Molecular Formula |
C27H33IN2S2 |
Molecular Weight |
576.60 |
CAS Registry Number |
53213-86-8 |
SMILES |
C4=C3N(\C(=C\C=CC2=[N+](C1=CC=CC=C1S2)CCCCC)SC3=CC=C4)CCCCC.[I-] |
InChI |
1S/C27H33N2S2.HI/c1-3-5-11-20-28-22-14-7-9-16-24(22)30-26(28)18-13-19-27-29(21-12-6-4-2)23-15-8-10-17-25(23)31-27;/h7-10,13-19H,3-6,11-12,20-21H2,1-2H3;1H/q+1;/p-1 |
InChIKey |
XKLVNGIUXSOJRR-UHFFFAOYSA-M |
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