N,N-dimethyl-4-(3-methyl-1,3-benzothiazol-3-ium-2-yl)aniline

Systemtic Name: N,N-dimethyl-4-(3-methyl-1,3-benzothiazol-3-ium-2-yl)aniline Openeye Name: N,N-dimethyl-4-(3-methyl-1,3-benzothiazol-3-ium-2-yl)aniline CAS Name: N,N-dimethyl-4-(3-methyl-1,3-benzothiazol-3-ium-2-yl)aniline IUPAC Name: N,N-dimethyl-4-(3-methyl-1,3-benzothiazol-3-ium-2-yl)aniline Traditional Name: dimethyl-[4-(3-methyl-1,3-benzothiazol-3-ium-2-yl)phenyl]amine Formula: C16H17N2S+ MolecularWeight: 269.38458

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(SC2=CC=CC=C21)C3=CC=C(C=C3)N(C)C

Isomeric SMILES

C[N+]1=C(SC2=CC=CC=C21)C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C16H17N2S/c1-17(2)13-10-8-12(9-11-13)16-18(3)14-6-4-5-7-15(14)19-16/h4-11H,1-3H3/q+1