N-[5-(2,2-dimethylpropylamino)-4-(1H-imidazol-2-ylmethylamino)-1-(1-naphthalen-1-ylethylamino)-1-oxidanylidene-pentan-2-yl]-N-methyl-benzamide

Systemtic Name: N-[5-(2,2-dimethylpropylamino)-4-(1H-imidazol-2-ylmethylamino)-1-(1-naphthalen-1-ylethylamino)-1-oxidanylidene-pentan-2-yl]-N-methyl-benzamide Openeye Name: N-[4-(2,2-dimethylpropylamino)-3-(1H-imidazol-2-ylmethylamino)-1-[1-(1-naphthyl)ethylcarbamoyl]butyl]-N-methyl-benzamide CAS Name: N-[5-(2,2-dimethylpropylamino)-4-(1H-imidazol-2-ylmethylamino)-1-[1-(1-naphthalenyl)ethylamino]-1-oxopentan-2-yl]-N-methylbenzamide IUPAC Name: N-[5-(2,2-dimethylpropylamino)-4-(1H-imidazol-2-ylmethylamino)-1-(1-naphthalen-1-ylethylamino)-1-oxopentan-2-yl]-N-methylbenzamide Traditional Name: N-[3-(1H-imidazol-2-ylmethylamino)-1-[1-(1-naphthyl)ethylcarbamoyl]-4-(neopentylamino)butyl]-N-methyl-benzamide Formula: C34H44N6O2 MolecularWeight: 568.75216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C(CC(CNCC(C)(C)C)NCC3=NC=CN3)N(C)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C(CC(CNCC(C)(C)C)NCC3=NC=CN3)N(C)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C34H44N6O2/c1-24(28-17-11-15-25-12-9-10-16-29(25)28)39-32(41)30(40(5)33(42)26-13-7-6-8-14-26)20-27(21-35-23-34(2,3)4)38-22-31-36-18-19-37-31/h6-19,24,27,30,35,38H,20-23H2,1-5H3,(H,36,37)(H,39,41)