N-(5-propyl-1,3,4-thiadiazol-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide

Systemtic Name: N-(5-propyl-1,3,4-thiadiazol-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide Openeye Name: N-(5-propyl-1,3,4-thiadiazol-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide CAS Name: N-(5-propyl-1,3,4-thiadiazol-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide IUPAC Name: N-(5-propyl-1,3,4-thiadiazol-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Traditional Name: N-(5-propyl-1,3,4-thiadiazol-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Formula: C16H21N4OS+ MolecularWeight: 317.42914

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)NC(=O)C[NH+]2CCC3=CC=CC=C3C2

Isomeric SMILES

CCCC1=NN=C(S1)NC(=O)C[NH+]2CCC3=CC=CC=C3C2

InChI

InChI=1S/C16H20N4OS/c1-2-5-15-18-19-16(22-15)17-14(21)11-20-9-8-12-6-3-4-7-13(12)10-20/h3-4,6-7H,2,5,8-11H2,1H3,(H,17,19,21)/p+1