tert-butyl (4S)-5-oxidanylidene-4-[(6-phenylpyridin-2-yl)carbonylamino]-5-(4-propanoylpiperazin-1-yl)pentanoate

Systemtic Name: tert-butyl (4S)-5-oxidanylidene-4-[(6-phenylpyridin-2-yl)carbonylamino]-5-(4-propanoylpiperazin-1-yl)pentanoate Openeye Name: tert-butyl (4S)-5-oxo-4-[(6-phenylpyridine-2-carbonyl)amino]-5-(4-propanoylpiperazin-1-yl)pentanoate CAS Name: (4S)-5-oxo-4-[[oxo-(6-phenyl-2-pyridinyl)methyl]amino]-5-[4-(1-oxopropyl)-1-piperazinyl]pentanoic acid tert-butyl ester IUPAC Name: tert-butyl (4S)-5-oxo-4-[(6-phenylpyridine-2-carbonyl)amino]-5-(4-propanoylpiperazin-1-yl)pentanoate Traditional Name: (4S)-5-keto-4-[(6-phenylpicolinoyl)amino]-5-(4-propionylpiperazino)valeric acid tert-butyl ester Formula: C28H36N4O5 MolecularWeight: 508.60924

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C(=O)C(CCC(=O)OC(C)(C)C)NC(=O)C2=CC=CC(=N2)C3=CC=CC=C3

Isomeric SMILES

CCC(=O)N1CCN(CC1)C(=O)[C@H](CCC(=O)OC(C)(C)C)NC(=O)C2=CC=CC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C28H36N4O5/c1-5-24(33)31-16-18-32(19-17-31)27(36)23(14-15-25(34)37-28(2,3)4)30-26(35)22-13-9-12-21(29-22)20-10-7-6-8-11-20/h6-13,23H,5,14-19H2,1-4H3,(H,30,35)/t23-/m0/s1