3-(4-fluorophenyl)-6-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-[1,3]thiazolo[2,3-c][1,2,4]triazole

Systemtic Name: 3-(4-fluorophenyl)-6-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-[1,3]thiazolo[2,3-c][1,2,4]triazole Openeye Name: 3-(4-fluorophenyl)-6-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)thiazolo[2,3-c][1,2,4]triazole CAS Name: 3-(4-fluorophenyl)-6-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)thiazolo[2,3-c][1,2,4]triazole IUPAC Name: 3-(4-fluorophenyl)-6-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-[1,3]thiazolo[2,3-c][1,2,4]triazole Traditional Name: 3-(4-fluorophenyl)-6-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)thiazolo[2,3-c][1,2,4]triazole Formula: C20H18FN4S+ MolecularWeight: 365.447123

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=CC=CC=C21)CC3=CN4C(=NN=C4S3)C5=CC=C(C=C5)F

Isomeric SMILES

C1C[NH+](CC2=CC=CC=C21)CC3=CN4C(=NN=C4S3)C5=CC=C(C=C5)F

InChI

InChI=1S/C20H17FN4S/c21-17-7-5-15(6-8-17)19-22-23-20-25(19)13-18(26-20)12-24-10-9-14-3-1-2-4-16(14)11-24/h1-8,13H,9-12H2/p+1