5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(2-pyridin-2-ylethyl)-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(2-pyridin-2-ylethyl)-1,2-oxazole-3-carboxamide Openeye Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[2-(2-pyridyl)ethyl]isoxazole-3-carboxamide CAS Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[2-(2-pyridinyl)ethyl]-3-isoxazolecarboxamide IUPAC Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(2-pyridin-2-ylethyl)-1,2-oxazole-3-carboxamide Traditional Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[2-(2-pyridyl)ethyl]isoxazole-3-carboxamide Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC3=CC(=NO3)C(=O)NCCC4=CC=CC=N4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC3=CC(=NO3)C(=O)NCCC4=CC=CC=N4

InChI

InChI=1S/C21H22N4O2/c26-21(23-11-8-18-7-3-4-10-22-18)20-13-19(27-24-20)15-25-12-9-16-5-1-2-6-17(16)14-25/h1-7,10,13H,8-9,11-12,14-15H2,(H,23,26)