N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-(1,2,4-triazol-1-yl)propanamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-(1,2,4-triazol-1-yl)propanamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-(1,2,4-triazol-1-yl)propanamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-(1,2,4-triazol-1-yl)propanamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-(1,2,4-triazol-1-yl)propanamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-(1,2,4-triazol-1-yl)propionamide Formula: C16H21N5O MolecularWeight: 299.37084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCN1CCC2=CC=CC=C2C1)N3C=NC=N3

Isomeric SMILES

CC(C(=O)NCCN1CCC2=CC=CC=C2C1)N3C=NC=N3

InChI

InChI=1S/C16H21N5O/c1-13(21-12-17-11-19-21)16(22)18-7-9-20-8-6-14-4-2-3-5-15(14)10-20/h2-5,11-13H,6-10H2,1H3,(H,18,22)