2-[(Z)-(2-chloranyl-1-methyl-1H-quinolin-1-ium-4-ylidene)methyl]-3-ethyl-2H-1,3-benzothiazole chloride

Systemtic Name: 2-[(Z)-(2-chloranyl-1-methyl-1H-quinolin-1-ium-4-ylidene)methyl]-3-ethyl-2H-1,3-benzothiazole chloride Openeye Name: 2-[(Z)-(2-chloro-1-methyl-1H-quinolin-1-ium-4-ylidene)methyl]-3-ethyl-2H-1,3-benzothiazole chloride CAS Name: 2-[(Z)-(2-chloro-1-methyl-1H-quinolin-1-ium-4-ylidene)methyl]-3-ethyl-2H-1,3-benzothiazole chloride IUPAC Name: 2-[(Z)-(2-chloro-1-methyl-1H-quinolin-1-ium-4-ylidene)methyl]-3-ethyl-2H-1,3-benzothiazole chloride Traditional Name: 2-[(Z)-(2-chloro-1-methyl-1H-quinolin-1-ium-4-ylidene)methyl]-3-ethyl-2H-1,3-benzothiazole chloride Formula: C20H20Cl2N2S MolecularWeight: 391.3572

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(SC2=CC=CC=C21)C=C3C=C([NH+](C4=CC=CC=C43)C)Cl.[Cl-]

Isomeric SMILES

CCN1C(SC2=CC=CC=C21)/C=C\3/C=C([NH+](C4=CC=CC=C43)C)Cl.[Cl-]

InChI

InChI=1S/C20H19ClN2S.ClH/c1-3-23-17-10-6-7-11-18(17)24-20(23)13-14-12-19(21)22(2)16-9-5-4-8-15(14)16;/h4-13,20H,3H2,1-2H3;1H/b14-13-;