(2Z)-2-[(1-ethyl-7-methyl-quinolin-1-ium-2-yl)methylidene]-5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazole

Systemtic Name: (2Z)-2-[(1-ethyl-7-methyl-quinolin-1-ium-2-yl)methylidene]-5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazole Openeye Name: (2Z)-3-allyl-2-[(1-ethyl-7-methyl-quinolin-1-ium-2-yl)methylene]-5,6-dimethyl-1,3-benzothiazole CAS Name: (2Z)-2-[(1-ethyl-7-methyl-2-quinolin-1-iumyl)methylidene]-5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazole IUPAC Name: (2Z)-2-[(1-ethyl-7-methylquinolin-1-ium-2-yl)methylidene]-5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazole Traditional Name: (2Z)-3-allyl-2-[(1-ethyl-7-methyl-quinolin-1-ium-2-yl)methylene]-5,6-dimethyl-1,3-benzothiazole Formula: C25H27N2S+ MolecularWeight: 387.56028

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(C=CC2=C1C=C(C=C2)C)C=C3N(C4=C(S3)C=C(C(=C4)C)C)CC=C

Isomeric SMILES

CC[N+]1=C(C=CC2=C1C=C(C=C2)C)/C=C\3/N(C4=C(S3)C=C(C(=C4)C)C)CC=C

InChI

InChI=1S/C25H27N2S/c1-6-12-27-23-14-18(4)19(5)15-24(23)28-25(27)16-21-11-10-20-9-8-17(3)13-22(20)26(21)7-2/h6,8-11,13-16H,1,7,12H2,2-5H3/q+1