2-[(1Z)-1-(1-cyclohexyl-2H-quinolin-1-ium-3-ylidene)ethyl]-1,3-benzothiazole

Systemtic Name: 2-[(1Z)-1-(1-cyclohexyl-2H-quinolin-1-ium-3-ylidene)ethyl]-1,3-benzothiazole Openeye Name: 2-[(1Z)-1-(1-cyclohexyl-2H-quinolin-1-ium-3-ylidene)ethyl]-1,3-benzothiazole CAS Name: 2-[(1Z)-1-(1-cyclohexyl-2H-quinolin-1-ium-3-ylidene)ethyl]-1,3-benzothiazole IUPAC Name: 2-[(1Z)-1-(1-cyclohexyl-2H-quinolin-1-ium-3-ylidene)ethyl]-1,3-benzothiazole Traditional Name: 2-[(1Z)-1-(1-cyclohexyl-2H-quinolin-1-ium-3-ylidene)ethyl]-1,3-benzothiazole Formula: C24H25N2S+ MolecularWeight: 373.5337

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C[N+](=C2C=CC=CC2=C1)C3CCCCC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C/C(=C\1/C[N+](=C2C=CC=CC2=C1)C3CCCCC3)/C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H25N2S/c1-17(24-25-21-12-6-8-14-23(21)27-24)19-15-18-9-5-7-13-22(18)26(16-19)20-10-3-2-4-11-20/h5-9,12-15,20H,2-4,10-11,16H2,1H3/q+1/b19-17-