2-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1,2,3-triazol-1-yl]-N,N-diethyl-ethanamide

Systemtic Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1,2,3-triazol-1-yl]-N,N-diethyl-ethanamide Openeye Name: 2-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)triazol-1-yl]-N,N-diethyl-acetamide CAS Name: 2-[4-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-1-triazolyl]-N,N-diethylacetamide IUPAC Name: 2-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)triazol-1-yl]-N,N-diethylacetamide Traditional Name: 2-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)triazol-1-yl]-N,N-diethyl-acetamide Formula: C18H23N5O2 MolecularWeight: 341.40752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CN1C=C(N=N1)C(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CCN(CC)C(=O)CN1C=C(N=N1)C(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C18H23N5O2/c1-3-21(4-2)17(24)13-23-12-16(19-20-23)18(25)22-10-9-14-7-5-6-8-15(14)11-22/h5-8,12H,3-4,9-11,13H2,1-2H3