N-[(E)-2-(3-ethylbenzo[g][1,3]benzothiazol-3-ium-2-yl)ethenyl]-N-phenyl-ethanamide

Systemtic Name: N-[(E)-2-(3-ethylbenzo[g][1,3]benzothiazol-3-ium-2-yl)ethenyl]-N-phenyl-ethanamide Openeye Name: N-[(E)-2-(3-ethylbenzo[g][1,3]benzothiazol-3-ium-2-yl)vinyl]-N-phenyl-acetamide CAS Name: N-[(E)-2-(3-ethyl-2-benzo[g][1,3]benzothiazol-3-iumyl)ethenyl]-N-phenylacetamide IUPAC Name: N-[(E)-2-(3-ethylbenzo[g][1,3]benzothiazol-3-ium-2-yl)ethenyl]-N-phenylacetamide Traditional Name: N-[(E)-2-(3-ethylbenzo[g][1,3]benzothiazol-3-ium-2-yl)vinyl]-N-phenyl-acetamide Formula: C23H21N2OS+ MolecularWeight: 373.49064

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(SC2=C1C=CC3=CC=CC=C32)C=CN(C4=CC=CC=C4)C(=O)C

Isomeric SMILES

CC[N+]1=C(SC2=C1C=CC3=CC=CC=C32)/C=C/N(C4=CC=CC=C4)C(=O)C

InChI

InChI=1S/C23H21N2OS/c1-3-24-21-14-13-18-9-7-8-12-20(18)23(21)27-22(24)15-16-25(17(2)26)19-10-5-4-6-11-19/h4-16H,3H2,1-2H3/q+1