2-[(E)-2-(2-(DIMETHYLAMINO)-3-((E)-2-[3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE]ETHYLIDENE)-1-CYCLOHEXEN-1-YL)ETHENYL]-3-ETHYL-1,3-BENZOTHIAZOL-3-IUM IODIDE

pro_cas
70446-11-6
pro_cdbregno
CCD00594467
pro_formula
C30 H34 N3 S2 . I
pro_molWeight
627.652

basic_info

Product_Name: 2-[(E)-2-(2-(DIMETHYLAMINO)-3-((E)-2-[3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE]ETHYLIDENE)-1-CYCLOHEXEN-1-YL)ETHENYL]-3-ETHYL-1,3-BENZOTHIAZOL-3-IUM IODIDE
CAS: 70446-11-6
EnglishSynonyms: 2-[(E)-2-(2-(DIMETHYLAMINO)-3-((E)-2-[3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE]ETHYLIDENE)-1-CYCLOHEXEN-1-YL)ETHENYL]-3-ETHYL-1,3-BENZOTHIAZOL-3-IUM IODIDE
pro_mdlNumber: MFCD07433806
pro_acceptors: 3
pro_donors: 0
pro_smile: CC[n+]1c2ccccc2sc1/C=C/C3=C(/C(=C/C=C\4/N(c5ccccc5S4)CC)/CCC3)N(C)C.[I-]
InChi: InChI=1S/C30H34N3S2.HI/c1-5-32-24-14-7-9-16-26(24)34-28(32)20-18-22-12-11-13-23(30(22)31(3)4)19-21-29-33(6-2)25-15-8-10-17-27(25)35-29;/h7-10,14-21H,5-6,11-13H2,1-4H3;1H/q+1;/p-1
InChiKey: InChIKey=YNTQDNMFDYPKBR-UHFFFAOYSA-M

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