N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(pyridin-3-ylmethylcarbamoyl)phenyl]naphthalene-2-carboxamide

Systemtic Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(pyridin-3-ylmethylcarbamoyl)phenyl]naphthalene-2-carboxamide Openeye Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-pyridylmethylcarbamoyl)phenyl]naphthalene-2-carboxamide CAS Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[oxo-(3-pyridinylmethylamino)methyl]phenyl]-2-naphthalenecarboxamide IUPAC Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(pyridin-3-ylmethylcarbamoyl)phenyl]naphthalene-2-carboxamide Traditional Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-pyridylmethylcarbamoyl)phenyl]-2-naphthamide Formula: C33H28N4O2 MolecularWeight: 512.60102

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)NC(=O)C4=CC5=CC=CC=C5C=C4)C(=O)NCC6=CN=CC=C6

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)NC(=O)C4=CC5=CC=CC=C5C=C4)C(=O)NCC6=CN=CC=C6

InChI

InChI=1S/C33H28N4O2/c38-32(27-12-11-24-7-1-3-9-26(24)18-27)36-29-13-14-31(37-17-15-25-8-2-4-10-28(25)22-37)30(19-29)33(39)35-21-23-6-5-16-34-20-23/h1-14,16,18-20H,15,17,21-22H2,(H,35,39)(H,36,38)