N-[5-methyl-3-(phenylcarbonyl)thiophen-2-yl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide

Systemtic Name: N-[5-methyl-3-(phenylcarbonyl)thiophen-2-yl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide Openeye Name: N-(3-benzoyl-5-methyl-2-thienyl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide CAS Name: N-(3-benzoyl-5-methyl-2-thiophenyl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide IUPAC Name: N-(3-benzoyl-5-methylthiophen-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Traditional Name: N-(3-benzoyl-5-methyl-2-thienyl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Formula: C23H23N2O2S+ MolecularWeight: 391.50592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C[NH+]2CCC3=CC=CC=C3C2)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C[NH+]2CCC3=CC=CC=C3C2)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H22N2O2S/c1-16-13-20(22(27)18-8-3-2-4-9-18)23(28-16)24-21(26)15-25-12-11-17-7-5-6-10-19(17)14-25/h2-10,13H,11-12,14-15H2,1H3,(H,24,26)/p+1