4-[(E)-2-[3-(2-cyclohexylethyl)-2H-1,3-benzothiazol-2-yl]ethenyl]-N,N-dimethyl-aniline iodide

Systemtic Name: 4-[(E)-2-[3-(2-cyclohexylethyl)-2H-1,3-benzothiazol-2-yl]ethenyl]-N,N-dimethyl-aniline iodide Openeye Name: 4-[(E)-2-[3-(2-cyclohexylethyl)-2H-1,3-benzothiazol-2-yl]vinyl]-N,N-dimethyl-aniline iodide CAS Name: 4-[(E)-2-[3-(2-cyclohexylethyl)-2H-1,3-benzothiazol-2-yl]ethenyl]-N,N-dimethylaniline iodide IUPAC Name: 4-[(E)-2-[3-(2-cyclohexylethyl)-2H-1,3-benzothiazol-2-yl]ethenyl]-N,N-dimethylaniline iodide Traditional Name: [4-[(E)-2-[3-(2-cyclohexylethyl)-2H-1,3-benzothiazol-2-yl]vinyl]phenyl]-dimethyl-amine iodide Formula: C25H32IN2S- MolecularWeight: 519.50445

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=CC2N(C3=CC=CC=C3S2)CCC4CCCCC4.[I-]

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C/C2N(C3=CC=CC=C3S2)CCC4CCCCC4.[I-]

InChI

InChI=1S/C25H32N2S.HI/c1-26(2)22-15-12-21(13-16-22)14-17-25-27(19-18-20-8-4-3-5-9-20)23-10-6-7-11-24(23)28-25;/h6-7,10-17,20,25H,3-5,8-9,18-19H2,1-2H3;1H/p-1/b17-14+;