2-[(2E)-6-methyl-2-[(E)-3-(1-propan-2-ylquinolin-1-ium-4-yl)prop-2-enylidene]-1,3-benzothiazol-3-yl]ethanol

Systemtic Name: 2-[(2E)-6-methyl-2-[(E)-3-(1-propan-2-ylquinolin-1-ium-4-yl)prop-2-enylidene]-1,3-benzothiazol-3-yl]ethanol Openeye Name: 2-[(2E)-2-[(E)-3-(1-isopropylquinolin-1-ium-4-yl)prop-2-enylidene]-6-methyl-1,3-benzothiazol-3-yl]ethanol CAS Name: 2-[(2E)-6-methyl-2-[(E)-3-(1-propan-2-yl-4-quinolin-1-iumyl)prop-2-enylidene]-1,3-benzothiazol-3-yl]ethanol IUPAC Name: 2-[(2E)-6-methyl-2-[(E)-3-(1-propan-2-ylquinolin-1-ium-4-yl)prop-2-enylidene]-1,3-benzothiazol-3-yl]ethanol Traditional Name: 2-[(2E)-2-[(E)-3-(1-isopropylquinolin-1-ium-4-yl)prop-2-enylidene]-6-methyl-1,3-benzothiazol-3-yl]ethanol Formula: C25H27N2OS+ MolecularWeight: 403.55968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=CC=CC3=CC=[N+](C4=CC=CC=C34)C(C)C)S2)CCO

Isomeric SMILES

CC1=CC2=C(C=C1)N(/C(=C\C=C\C3=CC=[N+](C4=CC=CC=C34)C(C)C)/S2)CCO

InChI

InChI=1S/C25H27N2OS/c1-18(2)26-14-13-20(21-8-4-5-9-22(21)26)7-6-10-25-27(15-16-28)23-12-11-19(3)17-24(23)29-25/h4-14,17-18,28H,15-16H2,1-3H3/q+1