3-ethyl-2-[7-(3-ethyl-1,3-benzothiazol-2-ylidene)hepta-1,3,5-trien-1-yl]-1,3-benzothiazol-3-ium iodide

CAS: 3071-70-3

Formula: C25H25IN2S2

SMILES: [I-].CCN1C(SC2=CC=CC=C12)=CC=CC=CC=CC1=[N+](CC)C2=CC=CC=C2S1

IUPAC: 3-ethyl-2-[7-(3-ethyl-2,3-dihydro-1,3-benzothiazol-2-ylidene)hepta-1,3,5-trien-1-yl]-1,3-benzothiazol-3-ium iodide

InChI: InChI=1S/C25H25N2S2.HI/c1-3-26-20-14-10-12-16-22(20)28-24(26)18-8-6-5-7-9-19-25-27(4-2)21-15-11-13-17-23(21)29-25;/h5-19H,3-4H2,1-2H3;1H/q+1;/p-1

Composition: C (55.15%), H (4.63%), I (23.31%), N (5.14%), S (11.78%)

Molar Mass: 544.51

Atom Count: 55

Heavy Atom Count: 30