2-[(E)-3-(1,3-diethylbenzo[f]benzimidazol-2-ylidene)prop-1-enyl]-3-ethyl-1,3-benzothiazol-3-ium

Systemtic Name: 2-[(E)-3-(1,3-diethylbenzo[f]benzimidazol-2-ylidene)prop-1-enyl]-3-ethyl-1,3-benzothiazol-3-ium Openeye Name: 2-[(E)-3-(1,3-diethylbenzo[f]benzimidazol-2-ylidene)prop-1-enyl]-3-ethyl-1,3-benzothiazol-3-ium CAS Name: 2-[(E)-3-(1,3-diethyl-2-benzo[f]benzimidazolylidene)prop-1-enyl]-3-ethyl-1,3-benzothiazol-3-ium IUPAC Name: 2-[(E)-3-(1,3-diethylbenzo[f]benzimidazol-2-ylidene)prop-1-enyl]-3-ethyl-1,3-benzothiazol-3-ium Traditional Name: 2-[(E)-3-(1,3-diethylbenzo[f]benzimidazol-2-ylidene)prop-1-enyl]-3-ethyl-1,3-benzothiazol-3-ium Formula: C27H28N3S+ MolecularWeight: 426.59632

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC3=CC=CC=C3C=C2N(C1=CC=CC4=[N+](C5=CC=CC=C5S4)CC)CC

Isomeric SMILES

CCN1C2=CC3=CC=CC=C3C=C2N(C1=C/C=C/C4=[N+](C5=CC=CC=C5S4)CC)CC

InChI

InChI=1S/C27H28N3S/c1-4-28-23-18-20-12-7-8-13-21(20)19-24(23)29(5-2)26(28)16-11-17-27-30(6-3)22-14-9-10-15-25(22)31-27/h7-19H,4-6H2,1-3H3/q+1