3-[2-[2-[(2-tert-butylphenyl)methyl]-3-oxidanylidene-pyridazin-4-yl]butanoylamino]-5-fluoranyl-4-oxidanylidene-pentanoic acid

Systemtic Name: 3-[2-[2-[(2-tert-butylphenyl)methyl]-3-oxidanylidene-pyridazin-4-yl]butanoylamino]-5-fluoranyl-4-oxidanylidene-pentanoic acid Openeye Name: 3-[2-[2-[(2-tert-butylphenyl)methyl]-3-oxo-pyridazin-4-yl]butanoylamino]-5-fluoro-4-oxo-pentanoic acid CAS Name: 3-[[2-[2-[(2-tert-butylphenyl)methyl]-3-oxo-4-pyridazinyl]-1-oxobutyl]amino]-5-fluoro-4-oxopentanoic acid IUPAC Name: 3-[2-[2-[(2-tert-butylphenyl)methyl]-3-oxopyridazin-4-yl]butanoylamino]-5-fluoro-4-oxopentanoic acid Traditional Name: 3-[2-[2-(2-tert-butylbenzyl)-3-keto-pyridazin-4-yl]butanoylamino]-5-fluoro-4-keto-valeric acid Formula: C24H30FN3O5 MolecularWeight: 459.510503

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=NN(C1=O)CC2=CC=CC=C2C(C)(C)C)C(=O)NC(CC(=O)O)C(=O)CF

Isomeric SMILES

CCC(C1=CC=NN(C1=O)CC2=CC=CC=C2C(C)(C)C)C(=O)NC(CC(=O)O)C(=O)CF

InChI

InChI=1S/C24H30FN3O5/c1-5-16(22(32)27-19(12-21(30)31)20(29)13-25)17-10-11-26-28(23(17)33)14-15-8-6-7-9-18(15)24(2,3)4/h6-11,16,19H,5,12-14H2,1-4H3,(H,27,32)(H,30,31)