N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide

Systemtic Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide Openeye Name: N-(4,5-dimethylthiazol-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide CAS Name: N-(4,5-dimethyl-2-thiazolyl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide IUPAC Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Traditional Name: N-(4,5-dimethylthiazol-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Formula: C16H20N3OS+ MolecularWeight: 302.4145

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C[NH+]2CCC3=CC=CC=C3C2)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C[NH+]2CCC3=CC=CC=C3C2)C

InChI

InChI=1S/C16H19N3OS/c1-11-12(2)21-16(17-11)18-15(20)10-19-8-7-13-5-3-4-6-14(13)9-19/h3-6H,7-10H2,1-2H3,(H,17,18,20)/p+1