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

Systemtic Name: N-[4,5-dimethyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)thiophen-2-yl]ethanamide Openeye Name: N-[4,5-dimethyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-2-thienyl]acetamide CAS Name: N-[4,5-dimethyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-2-thiophenyl]acetamide IUPAC Name: N-[4,5-dimethyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)thiophen-2-yl]acetamide Traditional Name: N-[4,5-dimethyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-2-thienyl]acetamide Formula: C18H23N2OS+ MolecularWeight: 315.45302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2OS/c1-12-13(2)22-18(19-14(3)21)17(12)11-20-9-8-15-6-4-5-7-16(15)10-20/h4-7H,8-11H2,1-3H3,(H,19,21)/p+1