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

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(1,2,4-triazol-1-yl)pyridin-3-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(1,2,4-triazol-1-yl)-3-pyridyl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(1,2,4-triazol-1-yl)pyridin-3-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(1,2,4-triazol-1-yl)-3-pyridyl]methanone Formula: C17H15N5O MolecularWeight: 305.3339

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=C(N=CC=C3)N4C=NC=N4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=C(N=CC=C3)N4C=NC=N4

InChI

InChI=1S/C17H15N5O/c23-17(21-9-7-13-4-1-2-5-14(13)10-21)15-6-3-8-19-16(15)22-12-18-11-20-22/h1-6,8,11-12H,7,9-10H2