| Name: | 3-ETHYL-2-[(3-((E)-3-[3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE]-1-PROPENYL)-5,5-DIMETHYL-2-CYCLOHEXEN-1-YLIDENE)METHYL]-1,3-BENZOTHIAZOL-3-IUM IODIDE |
| CAS: | 83846-69-9 |
| Synonyms: | DNTTCI ; BENZOTHIAZOLIUM, 3-ETHYL-2-[3-[3-[(3-ETHYL-2(3H)-BENZOTHIAZOLYLIDENE)METHYL]-5,5-DIMETHYL-2-CYCLOHEXEN-1-YLIDENE]-1-PROPENYL]-, IODIDE ; 3-ETHYL-2-[(3-((E)-3-[3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE]-1-PROPENYL)-5,5-DIMETHYL-2-CYCLOHEXEN-1-YLIDENE)METHYL]-1,3-BENZOTHIAZOL-3-IUM IODIDE ; 3-ETHYL-2-[[3-[3-(3-ETHYL-2-BENZOTHIAZOLINYLIDENE)PROPENYL]-5,5-DIMETHYL-2-CYCLOHEXEN-1-YLIDENE]METHYL]BENZOTHIAZOLIUM IODIDE ; 3-ETHYL-2-[3-[3-[(3-ETHYL-3H-BENZOTHIAZOL-2-YLIDENE)METHYL]-5,5-DIMETHYLCYCLOHEX-2-EN-1-YLIDENE]PROP-1-ENYL]BENZOTHIAZOLIUM IODIDE |
| MDL.: | MFCD03619559 |
| H bond acceptor: | 2 |
| H bond donor: | 0 |
| Smile: | CC[n+]1c2ccccc2sc1/C=C/3\CC(CC(=C3)/C=C/C=C\4/N(c5ccccc5S4)CC)(C)C.[I-] |
| InChi: | InChI=1S/C30H33N2S2.HI/c1-5-31-24-13-7-9-15-26(24)33-28(31)17-11-12-22-18-23(21-30(3,4)20-22)19-29-32(6-2)25-14-8-10-16-27(25)34-29;/h7-19H,5-6,20-21H2,1-4H3;1H/q+1;/p-1 |
| InChiKey: | InChIKey=XIKBXWGLIPMDCY-UHFFFAOYSA-M |
3-ETHYL-2-[(3-((E)-3-[3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE]-1-PROPENYL)-5,5-DIMETHYL-2-CYCLOHEXEN-
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