N-[4-azanyl-3,4-bis(oxidanylidene)-1-phenyl-butan-2-yl]-2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridine-3-carboxamide

Systemtic Name: N-[4-azanyl-3,4-bis(oxidanylidene)-1-phenyl-butan-2-yl]-2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridine-3-carboxamide Openeye Name: N-(3-amino-1-benzyl-2,3-dioxo-propyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridine-3-carboxamide CAS Name: N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyridinecarboxamide IUPAC Name: N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridine-3-carboxamide Traditional Name: N-(3-amino-1-benzyl-2,3-diketo-propyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)nicotinamide Formula: C25H24N4O3 MolecularWeight: 428.48306

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C=CC=N3)C(=O)NC(CC4=CC=CC=C4)C(=O)C(=O)N

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C=CC=N3)C(=O)NC(CC4=CC=CC=C4)C(=O)C(=O)N

InChI

InChI=1S/C25H24N4O3/c26-23(31)22(30)21(15-17-7-2-1-3-8-17)28-25(32)20-11-6-13-27-24(20)29-14-12-18-9-4-5-10-19(18)16-29/h1-11,13,21H,12,14-16H2,(H2,26,31)(H,28,32)