N-[4-(1H-imidazol-2-ylmethylamino)-5-[(3-methoxypyridin-2-yl)methylamino]-1-(1-naphthalen-1-ylethylamino)-1-oxidanylidene-pentan-2-yl]-N-methyl-benzamide

Systemtic Name: N-[4-(1H-imidazol-2-ylmethylamino)-5-[(3-methoxypyridin-2-yl)methylamino]-1-(1-naphthalen-1-ylethylamino)-1-oxidanylidene-pentan-2-yl]-N-methyl-benzamide Openeye Name: N-[3-(1H-imidazol-2-ylmethylamino)-4-[(3-methoxy-2-pyridyl)methylamino]-1-[1-(1-naphthyl)ethylcarbamoyl]butyl]-N-methyl-benzamide CAS Name: N-[4-(1H-imidazol-2-ylmethylamino)-5-[(3-methoxy-2-pyridinyl)methylamino]-1-[1-(1-naphthalenyl)ethylamino]-1-oxopentan-2-yl]-N-methylbenzamide IUPAC Name: N-[4-(1H-imidazol-2-ylmethylamino)-5-[(3-methoxypyridin-2-yl)methylamino]-1-(1-naphthalen-1-ylethylamino)-1-oxopentan-2-yl]-N-methylbenzamide Traditional Name: N-[3-(1H-imidazol-2-ylmethylamino)-4-[(3-methoxy-2-pyridyl)methylamino]-1-[1-(1-naphthyl)ethylcarbamoyl]butyl]-N-methyl-benzamide Formula: C36H41N7O3 MolecularWeight: 619.75584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C(CC(CNCC3=C(C=CC=N3)OC)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=C(C=CC=N3)OC)NCC4=NC=CN4)N(C)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C36H41N7O3/c1-25(29-16-9-14-26-11-7-8-15-30(26)29)42-35(44)32(43(2)36(45)27-12-5-4-6-13-27)21-28(41-24-34-39-19-20-40-34)22-37-23-31-33(46-3)17-10-18-38-31/h4-20,25,28,32,37,41H,21-24H2,1-3H3,(H,39,40)(H,42,44)