N,N-dimethyl-4-[(E)-2-[4-methyl-3-(3-methylbutyl)-1,3-thiazol-3-ium-2-yl]ethenyl]aniline

Systemtic Name: N,N-dimethyl-4-[(E)-2-[4-methyl-3-(3-methylbutyl)-1,3-thiazol-3-ium-2-yl]ethenyl]aniline Openeye Name: 4-[(E)-2-(3-isopentyl-4-methyl-thiazol-3-ium-2-yl)vinyl]-N,N-dimethyl-aniline CAS Name: N,N-dimethyl-4-[(E)-2-[4-methyl-3-(3-methylbutyl)-2-thiazol-3-iumyl]ethenyl]aniline IUPAC Name: N,N-dimethyl-4-[(E)-2-[4-methyl-3-(3-methylbutyl)-1,3-thiazol-3-ium-2-yl]ethenyl]aniline Traditional Name: [4-[(E)-2-(3-isoamyl-4-methyl-thiazol-3-ium-2-yl)vinyl]phenyl]-dimethyl-amine Formula: C19H27N2S+ MolecularWeight: 315.49608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=[N+]1CCC(C)C)C=CC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC1=CSC(=[N+]1CCC(C)C)/C=C/C2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C19H27N2S/c1-15(2)12-13-21-16(3)14-22-19(21)11-8-17-6-9-18(10-7-17)20(4)5/h6-11,14-15H,12-13H2,1-5H3/q+1