5-methoxy-3-methyl-2-[(E)-2-(2-phenyl-1H-indol-3-yl)ethenyl]-1,3-benzothiazol-3-ium

Systemtic Name: 5-methoxy-3-methyl-2-[(E)-2-(2-phenyl-1H-indol-3-yl)ethenyl]-1,3-benzothiazol-3-ium Openeye Name: 5-methoxy-3-methyl-2-[(E)-2-(2-phenyl-1H-indol-3-yl)vinyl]-1,3-benzothiazol-3-ium CAS Name: 5-methoxy-3-methyl-2-[(E)-2-(2-phenyl-1H-indol-3-yl)ethenyl]-1,3-benzothiazol-3-ium IUPAC Name: 5-methoxy-3-methyl-2-[(E)-2-(2-phenyl-1H-indol-3-yl)ethenyl]-1,3-benzothiazol-3-ium Traditional Name: 5-methoxy-3-methyl-2-[(E)-2-(2-phenyl-1H-indol-3-yl)vinyl]-1,3-benzothiazol-3-ium Formula: C25H21N2OS+ MolecularWeight: 397.51204

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(SC2=C1C=C(C=C2)OC)C=CC3=C(NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C[N+]1=C(SC2=C1C=C(C=C2)OC)/C=C/C3=C(NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C25H20N2OS/c1-27-22-16-18(28-2)12-14-23(22)29-24(27)15-13-20-19-10-6-7-11-21(19)26-25(20)17-8-4-3-5-9-17/h3-16H,1-2H3/p+1