N,N-diethyl-5-[(3-ethyl-1,3-benzothiazol-3-ium-2-yl)methylidene]-3-[(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]cyclohex-3-ene-1-carboxamide

Systemtic Name: N,N-diethyl-5-[(3-ethyl-1,3-benzothiazol-3-ium-2-yl)methylidene]-3-[(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]cyclohex-3-ene-1-carboxamide Openeye Name: N,N-diethyl-5-[(3-ethyl-1,3-benzothiazol-3-ium-2-yl)methylene]-3-[(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]cyclohex-3-ene-1-carboxamide CAS Name: N,N-diethyl-5-[(3-ethyl-1,3-benzothiazol-3-ium-2-yl)methylidene]-3-[(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]-1-cyclohex-3-enecarboxamide IUPAC Name: N,N-diethyl-5-[(3-ethyl-1,3-benzothiazol-3-ium-2-yl)methylidene]-3-[(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]cyclohex-3-ene-1-carboxamide Traditional Name: N,N-diethyl-5-[(3-ethyl-1,3-benzothiazol-3-ium-2-yl)methylene]-3-[(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]cyclohex-3-ene-1-carboxamide Formula: C31H36N3OS2+ MolecularWeight: 530.76704

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2SC1=CC3=CC(=CC4=[N+](C5=CC=CC=C5S4)CC)CC(C3)C(=O)N(CC)CC

Isomeric SMILES

CCN1C2=CC=CC=C2SC1=CC3=CC(=CC4=[N+](C5=CC=CC=C5S4)CC)CC(C3)C(=O)N(CC)CC

InChI

InChI=1S/C31H36N3OS2/c1-5-32(6-2)31(35)24-18-22(20-29-33(7-3)25-13-9-11-15-27(25)36-29)17-23(19-24)21-30-34(8-4)26-14-10-12-16-28(26)37-30/h9-17,20-21,24H,5-8,18-19H2,1-4H3/q+1