1-phenyl-N-[2-(1,3-thiazol-2-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]cyclopropane-1-carboxamide

Systemtic Name: 1-phenyl-N-[2-(1,3-thiazol-2-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]cyclopropane-1-carboxamide Openeye Name: 1-phenyl-N-[2-(thiazol-2-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]cyclopropanecarboxamide CAS Name: 1-phenyl-N-[2-(2-thiazolylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-1-cyclopropanecarboxamide IUPAC Name: 1-phenyl-N-[2-(1,3-thiazol-2-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]cyclopropane-1-carboxamide Traditional Name: 1-phenyl-N-[2-(thiazol-2-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]cyclopropanecarboxamide Formula: C23H24N3OS+ MolecularWeight: 390.52116

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=C1C=CC(=C2)NC(=O)C3(CC3)C4=CC=CC=C4)CC5=NC=CS5

Isomeric SMILES

C1C[NH+](CC2=C1C=CC(=C2)NC(=O)C3(CC3)C4=CC=CC=C4)CC5=NC=CS5

InChI

InChI=1S/C23H23N3OS/c27-22(23(9-10-23)19-4-2-1-3-5-19)25-20-7-6-17-8-12-26(15-18(17)14-20)16-21-24-11-13-28-21/h1-7,11,13-14H,8-10,12,15-16H2,(H,25,27)/p+1