N-[(E)-1-(3,4-diphenyl-1,3-thiazol-3-ium-2-yl)prop-1-en-2-yl]-4-ethoxy-aniline bromide

Systemtic Name: N-[(E)-1-(3,4-diphenyl-1,3-thiazol-3-ium-2-yl)prop-1-en-2-yl]-4-ethoxy-aniline bromide Openeye Name: N-[(E)-2-(3,4-diphenylthiazol-3-ium-2-yl)-1-methyl-vinyl]-4-ethoxy-aniline bromide CAS Name: N-[(E)-1-(3,4-diphenyl-2-thiazol-3-iumyl)prop-1-en-2-yl]-4-ethoxyaniline bromide IUPAC Name: N-[(E)-1-(3,4-diphenyl-1,3-thiazol-3-ium-2-yl)prop-1-en-2-yl]-4-ethoxyaniline bromide Traditional Name: [(E)-2-(3,4-diphenylthiazol-3-ium-2-yl)-1-methyl-vinyl]-p-phenetyl-amine bromide Formula: C26H25BrN2OS MolecularWeight: 493.4585

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=CC2=[N+](C(=CS2)C3=CC=CC=C3)C4=CC=CC=C4)C.[Br-]

Isomeric SMILES

CCOC1=CC=C(C=C1)N/C(=C/C2=[N+](C(=CS2)C3=CC=CC=C3)C4=CC=CC=C4)/C.[Br-]

InChI

InChI=1S/C26H24N2OS.BrH/c1-3-29-24-16-14-22(15-17-24)27-20(2)18-26-28(23-12-8-5-9-13-23)25(19-30-26)21-10-6-4-7-11-21;/h4-19H,3H2,1-2H3;1H