N-[4,5-dimethyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)thiophen-2-yl]benzamide

Systemtic Name: N-[4,5-dimethyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)thiophen-2-yl]benzamide Openeye Name: N-[4,5-dimethyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-2-thienyl]benzamide CAS Name: N-[4,5-dimethyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-2-thiophenyl]benzamide IUPAC Name: N-[4,5-dimethyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)thiophen-2-yl]benzamide Traditional Name: N-[4,5-dimethyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-2-thienyl]benzamide Formula: C23H25N2OS+ MolecularWeight: 377.5224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C[NH+]2CCC3=CC=CC=C3C2)NC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC(=C1C[NH+]2CCC3=CC=CC=C3C2)NC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C23H24N2OS/c1-16-17(2)27-23(24-22(26)19-9-4-3-5-10-19)21(16)15-25-13-12-18-8-6-7-11-20(18)14-25/h3-11H,12-15H2,1-2H3,(H,24,26)/p+1