N-[5-(azepan-1-yl)-1-(1-naphthalen-1-ylethylamino)-1-oxidanylidene-4-(pyridin-2-ylmethylamino)pentan-2-yl]-N-methyl-benzamide

Systemtic Name: N-[5-(azepan-1-yl)-1-(1-naphthalen-1-ylethylamino)-1-oxidanylidene-4-(pyridin-2-ylmethylamino)pentan-2-yl]-N-methyl-benzamide Openeye Name: N-[4-(azepan-1-yl)-1-[1-(1-naphthyl)ethylcarbamoyl]-3-(2-pyridylmethylamino)butyl]-N-methyl-benzamide CAS Name: N-[5-(1-azepanyl)-1-[1-(1-naphthalenyl)ethylamino]-1-oxo-4-(2-pyridinylmethylamino)pentan-2-yl]-N-methylbenzamide IUPAC Name: N-[5-(azepan-1-yl)-1-(1-naphthalen-1-ylethylamino)-1-oxo-4-(pyridin-2-ylmethylamino)pentan-2-yl]-N-methylbenzamide Traditional Name: N-[4-(azepan-1-yl)-1-[1-(1-naphthyl)ethylcarbamoyl]-3-(2-pyridylmethylamino)butyl]-N-methyl-benzamide Formula: C37H45N5O2 MolecularWeight: 591.7855

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C(CC(CN3CCCCCC3)NCC4=CC=CC=N4)N(C)C(=O)C5=CC=CC=C5

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C(CC(CN3CCCCCC3)NCC4=CC=CC=N4)N(C)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C37H45N5O2/c1-28(33-21-14-18-29-15-8-9-20-34(29)33)40-36(43)35(41(2)37(44)30-16-6-5-7-17-30)25-32(27-42-23-12-3-4-13-24-42)39-26-31-19-10-11-22-38-31/h5-11,14-22,28,32,35,39H,3-4,12-13,23-27H2,1-2H3,(H,40,43)