5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N-(phenylmethyl)-1H-imidazole-4-carboxamide

Systemtic Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N-(phenylmethyl)-1H-imidazole-4-carboxamide Openeye Name: N-benzyl-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1H-imidazole-4-carboxamide CAS Name: 5-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-N-(phenylmethyl)-1H-imidazole-4-carboxamide IUPAC Name: N-benzyl-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1H-imidazole-4-carboxamide Traditional Name: N-benzyl-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1H-imidazole-4-carboxamide Formula: C21H20N4O2 MolecularWeight: 360.4091

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=C(N=CN3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=C(N=CN3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C21H20N4O2/c26-20(22-12-15-6-2-1-3-7-15)18-19(24-14-23-18)21(27)25-11-10-16-8-4-5-9-17(16)13-25/h1-9,14H,10-13H2,(H,22,26)(H,23,24)