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

Systemtic Name: N-[4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1,3-thiazol-2-yl]ethanamide Openeye Name: N-[4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)thiazol-2-yl]acetamide CAS Name: N-[4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-2-thiazolyl]acetamide IUPAC Name: N-[4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1,3-thiazol-2-yl]acetamide Traditional Name: N-[4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)thiazol-2-yl]acetamide Formula: C15H18N3OS+ MolecularWeight: 288.38792

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)C[NH+]2CCC3=CC=CC=C3C2

Isomeric SMILES

CC(=O)NC1=NC(=CS1)C[NH+]2CCC3=CC=CC=C3C2

InChI

InChI=1S/C15H17N3OS/c1-11(19)16-15-17-14(10-20-15)9-18-7-6-12-4-2-3-5-13(12)8-18/h2-5,10H,6-9H2,1H3,(H,16,17,19)/p+1