(4S)-5-oxidanylidene-4-[(6-phenylpyridin-2-yl)carbonylamino]-5-(4-propanoyloxypiperazin-1-yl)pentanoic acid

Systemtic Name: (4S)-5-oxidanylidene-4-[(6-phenylpyridin-2-yl)carbonylamino]-5-(4-propanoyloxypiperazin-1-yl)pentanoic acid Openeye Name: (4S)-5-oxo-4-[(6-phenylpyridine-2-carbonyl)amino]-5-(4-propanoyloxypiperazin-1-yl)pentanoic acid CAS Name: (4S)-5-oxo-4-[[oxo-(6-phenyl-2-pyridinyl)methyl]amino]-5-[4-(1-oxopropoxy)-1-piperazinyl]pentanoic acid IUPAC Name: (4S)-5-oxo-4-[(6-phenylpyridine-2-carbonyl)amino]-5-(4-propanoyloxypiperazin-1-yl)pentanoic acid Traditional Name: (4S)-5-keto-4-[(6-phenylpicolinoyl)amino]-5-(4-propionyloxypiperazino)valeric acid Formula: C24H28N4O6 MolecularWeight: 468.50232

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)ON1CCN(CC1)C(=O)C(CCC(=O)O)NC(=O)C2=CC=CC(=N2)C3=CC=CC=C3

Isomeric SMILES

CCC(=O)ON1CCN(CC1)C(=O)[C@H](CCC(=O)O)NC(=O)C2=CC=CC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C24H28N4O6/c1-2-22(31)34-28-15-13-27(14-16-28)24(33)20(11-12-21(29)30)26-23(32)19-10-6-9-18(25-19)17-7-4-3-5-8-17/h3-10,20H,2,11-16H2,1H3,(H,26,32)(H,29,30)/t20-/m0/s1