N-[7-azanyl-1-[(4-ethanoylphenyl)methylamino]-1,2-bis(oxidanylidene)heptan-3-yl]-2-[[2,5-bis(fluoranyl)phenyl]methyl]-1,3-bis(oxidanylidene)-5,8-dihydro-[1,2,4]triazolo[1,2-a]pyridazine-5-carboxamide

Systemtic Name: N-[7-azanyl-1-[(4-ethanoylphenyl)methylamino]-1,2-bis(oxidanylidene)heptan-3-yl]-2-[[2,5-bis(fluoranyl)phenyl]methyl]-1,3-bis(oxidanylidene)-5,8-dihydro-[1,2,4]triazolo[1,2-a]pyridazine-5-carboxamide Openeye Name: N-[1-[2-[(4-acetylphenyl)methylamino]-2-oxo-acetyl]-5-amino-pentyl]-2-[(2,5-difluorophenyl)methyl]-1,3-dioxo-5,8-dihydro-[1,2,4]triazolo[1,2-a]pyridazine-5-carboxamide CAS Name: N-[1-[(4-acetylphenyl)methylamino]-7-amino-1,2-dioxoheptan-3-yl]-2-[(2,5-difluorophenyl)methyl]-1,3-dioxo-5,8-dihydro-[1,2,4]triazolo[1,2-a]pyridazine-5-carboxamide IUPAC Name: N-[1-[(4-acetylphenyl)methylamino]-7-amino-1,2-dioxoheptan-3-yl]-2-[(2,5-difluorophenyl)methyl]-1,3-dioxo-5,8-dihydro-[1,2,4]triazolo[1,2-a]pyridazine-5-carboxamide Traditional Name: N-[1-[2-[(4-acetylbenzyl)amino]-2-keto-acetyl]-5-amino-pentyl]-2-(2,5-difluorobenzyl)-1,3-diketo-5,8-dihydro-[1,2,4]triazolo[1,2-a]pyridazine-5-carboxamide Formula: C30H32F2N6O6 MolecularWeight: 610.608486

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)CNC(=O)C(=O)C(CCCCN)NC(=O)C2C=CCN3N2C(=O)N(C3=O)CC4=C(C=CC(=C4)F)F

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)CNC(=O)C(=O)C(CCCCN)NC(=O)C2C=CCN3N2C(=O)N(C3=O)CC4=C(C=CC(=C4)F)F

InChI

InChI=1S/C30H32F2N6O6/c1-18(39)20-9-7-19(8-10-20)16-34-28(42)26(40)24(5-2-3-13-33)35-27(41)25-6-4-14-37-29(43)36(30(44)38(25)37)17-21-15-22(31)11-12-23(21)32/h4,6-12,15,24-25H,2-3,5,13-14,16-17,33H2,1H3,(H,34,42)(H,35,41)