N-(1-oxidanylidene-3-phenyl-propan-2-yl)-2-[7-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]pyridine-3-carboxamide

Systemtic Name: N-(1-oxidanylidene-3-phenyl-propan-2-yl)-2-[7-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]pyridine-3-carboxamide Openeye Name: N-(1-benzyl-2-oxo-ethyl)-2-[7-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]pyridine-3-carboxamide CAS Name: N-(1-oxo-3-phenylpropan-2-yl)-2-[7-(1-pyrrolidinylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-pyridinecarboxamide IUPAC Name: N-(1-oxo-3-phenylpropan-2-yl)-2-[7-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]pyridine-3-carboxamide Traditional Name: N-(1-benzyl-2-keto-ethyl)-2-[7-(pyrrolidinomethyl)-3,4-dihydro-1H-isoquinolin-2-yl]nicotinamide Formula: C29H32N4O2 MolecularWeight: 468.58998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC3=C(CCN(C3)C4=C(C=CC=N4)C(=O)NC(CC5=CC=CC=C5)C=O)C=C2

Isomeric SMILES

C1CCN(C1)CC2=CC3=C(CCN(C3)C4=C(C=CC=N4)C(=O)NC(CC5=CC=CC=C5)C=O)C=C2

InChI

InChI=1S/C29H32N4O2/c34-21-26(18-22-7-2-1-3-8-22)31-29(35)27-9-6-13-30-28(27)33-16-12-24-11-10-23(17-25(24)20-33)19-32-14-4-5-15-32/h1-3,6-11,13,17,21,26H,4-5,12,14-16,18-20H2,(H,31,35)