(4S)-4-[(4-cyclopropyl-6-phenyl-pyridin-2-yl)carbonylamino]-5-(4-ethoxycarbonylpiperazin-1-yl)-5-oxidanylidene-pentanoic acid

Systemtic Name: (4S)-4-[(4-cyclopropyl-6-phenyl-pyridin-2-yl)carbonylamino]-5-(4-ethoxycarbonylpiperazin-1-yl)-5-oxidanylidene-pentanoic acid Openeye Name: (4S)-4-[(4-cyclopropyl-6-phenyl-pyridine-2-carbonyl)amino]-5-(4-ethoxycarbonylpiperazin-1-yl)-5-oxo-pentanoic acid CAS Name: (4S)-4-[[(4-cyclopropyl-6-phenyl-2-pyridinyl)-oxomethyl]amino]-5-(4-ethoxycarbonyl-1-piperazinyl)-5-oxopentanoic acid IUPAC Name: (4S)-4-[(4-cyclopropyl-6-phenylpyridine-2-carbonyl)amino]-5-(4-ethoxycarbonylpiperazin-1-yl)-5-oxopentanoic acid Traditional Name: (4S)-5-(4-carbethoxypiperazino)-4-[(4-cyclopropyl-6-phenyl-picolinoyl)amino]-5-keto-valeric acid Formula: C27H32N4O6 MolecularWeight: 508.56618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(CCC(=O)O)NC(=O)C2=CC(=CC(=N2)C3=CC=CC=C3)C4CC4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)[C@H](CCC(=O)O)NC(=O)C2=CC(=CC(=N2)C3=CC=CC=C3)C4CC4

InChI

InChI=1S/C27H32N4O6/c1-2-37-27(36)31-14-12-30(13-15-31)26(35)21(10-11-24(32)33)29-25(34)23-17-20(18-8-9-18)16-22(28-23)19-6-4-3-5-7-19/h3-7,16-18,21H,2,8-15H2,1H3,(H,29,34)(H,32,33)/t21-/m0/s1