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

Systemtic Name: N-[5-[(2-hydroxyphenyl)methylamino]-4-(1H-imidazol-2-ylmethylamino)-1-(1-naphthalen-1-ylethylamino)-1-oxidanylidene-pentan-2-yl]-N-methyl-benzamide Openeye Name: N-[4-[(2-hydroxyphenyl)methylamino]-3-(1H-imidazol-2-ylmethylamino)-1-[1-(1-naphthyl)ethylcarbamoyl]butyl]-N-methyl-benzamide CAS Name: N-[5-[(2-hydroxyphenyl)methylamino]-4-(1H-imidazol-2-ylmethylamino)-1-[1-(1-naphthalenyl)ethylamino]-1-oxopentan-2-yl]-N-methylbenzamide IUPAC Name: N-[5-[(2-hydroxyphenyl)methylamino]-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-(salicylamino)butyl]-N-methyl-benzamide Formula: C36H40N6O3 MolecularWeight: 604.7412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C(CC(CNCC3=CC=CC=C3O)NCC4=NC=CN4)N(C)C(=O)C5=CC=CC=C5

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C(CC(CNCC3=CC=CC=C3O)NCC4=NC=CN4)N(C)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C36H40N6O3/c1-25(30-17-10-15-26-11-6-8-16-31(26)30)41-35(44)32(42(2)36(45)27-12-4-3-5-13-27)21-29(40-24-34-38-19-20-39-34)23-37-22-28-14-7-9-18-33(28)43/h3-20,25,29,32,37,40,43H,21-24H2,1-2H3,(H,38,39)(H,41,44)