3,4-dihydro-1H-isoquinolin-2-yl-[4-(1,2,4-triazol-1-ylmethyl)phenyl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-(1,2,4-triazol-1-ylmethyl)phenyl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-(1,2,4-triazol-1-ylmethyl)phenyl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-(1,2,4-triazol-1-ylmethyl)phenyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-(1,2,4-triazol-1-ylmethyl)phenyl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-(1,2,4-triazol-1-ylmethyl)phenyl]methanone Formula: C19H18N4O MolecularWeight: 318.37242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C19H18N4O/c24-19(22-10-9-16-3-1-2-4-18(16)12-22)17-7-5-15(6-8-17)11-23-14-20-13-21-23/h1-8,13-14H,9-12H2