(2Z)-2-[(7-methoxy-1-propyl-quinolin-1-ium-2-yl)methylidene]-6-methyl-3-propyl-1,3-benzothiazole

Systemtic Name: (2Z)-2-[(7-methoxy-1-propyl-quinolin-1-ium-2-yl)methylidene]-6-methyl-3-propyl-1,3-benzothiazole Openeye Name: (2Z)-2-[(7-methoxy-1-propyl-quinolin-1-ium-2-yl)methylene]-6-methyl-3-propyl-1,3-benzothiazole CAS Name: (2Z)-2-[(7-methoxy-1-propyl-2-quinolin-1-iumyl)methylidene]-6-methyl-3-propyl-1,3-benzothiazole IUPAC Name: (2Z)-2-[(7-methoxy-1-propylquinolin-1-ium-2-yl)methylidene]-6-methyl-3-propyl-1,3-benzothiazole Traditional Name: (2Z)-2-[(7-methoxy-1-propyl-quinolin-1-ium-2-yl)methylene]-6-methyl-3-propyl-1,3-benzothiazole Formula: C25H29N2OS+ MolecularWeight: 405.57556

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)C)SC1=CC3=[N+](C4=C(C=CC(=C4)OC)C=C3)CCC

Isomeric SMILES

CCCN\1C2=C(C=C(C=C2)C)S/C1=C\C3=[N+](C4=C(C=CC(=C4)OC)C=C3)CCC

InChI

InChI=1S/C25H29N2OS/c1-5-13-26-20(10-8-19-9-11-21(28-4)17-23(19)26)16-25-27(14-6-2)22-12-7-18(3)15-24(22)29-25/h7-12,15-17H,5-6,13-14H2,1-4H3/q+1