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

Systemtic Name: N,N-diethyl-4-[(E)-2-(3-heptyl-2H-1,3-benzothiazol-2-yl)ethenyl]aniline iodide Openeye Name: N,N-diethyl-4-[(E)-2-(3-heptyl-2H-1,3-benzothiazol-2-yl)vinyl]aniline iodide CAS Name: N,N-diethyl-4-[(E)-2-(3-heptyl-2H-1,3-benzothiazol-2-yl)ethenyl]aniline iodide IUPAC Name: N,N-diethyl-4-[(E)-2-(3-heptyl-2H-1,3-benzothiazol-2-yl)ethenyl]aniline iodide Traditional Name: diethyl-[4-[(E)-2-(3-heptyl-2H-1,3-benzothiazol-2-yl)vinyl]phenyl]amine iodide Formula: C26H36IN2S- MolecularWeight: 535.54691

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(SC2=CC=CC=C21)C=CC3=CC=C(C=C3)N(CC)CC.[I-]

Isomeric SMILES

CCCCCCCN1C(SC2=CC=CC=C21)/C=C/C3=CC=C(C=C3)N(CC)CC.[I-]

InChI

InChI=1S/C26H36N2S.HI/c1-4-7-8-9-12-21-28-24-13-10-11-14-25(24)29-26(28)20-17-22-15-18-23(19-16-22)27(5-2)6-3;/h10-11,13-20,26H,4-9,12,21H2,1-3H3;1H/p-1/b20-17+;