ditert-butyl (2S)-2-[2-[6-oxidanylidene-3-phenyl-5-(phenylmethyl)pyridazin-1-yl]ethanoylamino]pentanedioate

Systemtic Name: ditert-butyl (2S)-2-[2-[6-oxidanylidene-3-phenyl-5-(phenylmethyl)pyridazin-1-yl]ethanoylamino]pentanedioate Openeye Name: ditert-butyl (2S)-2-[[2-(5-benzyl-6-oxo-3-phenyl-pyridazin-1-yl)acetyl]amino]pentanedioate CAS Name: (2S)-2-[[1-oxo-2-[6-oxo-3-phenyl-5-(phenylmethyl)-1-pyridazinyl]ethyl]amino]pentanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl (2S)-2-[[2-(5-benzyl-6-oxo-3-phenylpyridazin-1-yl)acetyl]amino]pentanedioate Traditional Name: (2S)-2-[[2-(5-benzyl-6-keto-3-phenyl-pyridazin-1-yl)acetyl]amino]glutaric acid ditert-butyl ester Formula: C32H39N3O6 MolecularWeight: 561.66856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC(C(=O)OC(C)(C)C)NC(=O)CN1C(=O)C(=CC(=N1)C2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)CC[C@@H](C(=O)OC(C)(C)C)NC(=O)CN1C(=O)C(=CC(=N1)C2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C32H39N3O6/c1-31(2,3)40-28(37)18-17-25(30(39)41-32(4,5)6)33-27(36)21-35-29(38)24(19-22-13-9-7-10-14-22)20-26(34-35)23-15-11-8-12-16-23/h7-16,20,25H,17-19,21H2,1-6H3,(H,33,36)/t25-/m0/s1