3-[2-(2-butan-2-yl-1-ethanoyl-3-oxidanylidene-5-phenyl-2H-pyrazin-4-yl)ethanoylamino]-2-oxidanyl-4-phenyl-butanoic acid

Systemtic Name: 3-[2-(2-butan-2-yl-1-ethanoyl-3-oxidanylidene-5-phenyl-2H-pyrazin-4-yl)ethanoylamino]-2-oxidanyl-4-phenyl-butanoic acid Openeye Name: 3-[[2-(1-acetyl-3-oxo-5-phenyl-2-sec-butyl-2H-pyrazin-4-yl)acetyl]amino]-2-hydroxy-4-phenyl-butanoic acid CAS Name: 3-[[2-(1-acetyl-2-butan-2-yl-3-oxo-5-phenyl-2H-pyrazin-4-yl)-1-oxoethyl]amino]-2-hydroxy-4-phenylbutanoic acid IUPAC Name: 3-[[2-(1-acetyl-2-butan-2-yl-3-oxo-5-phenyl-2H-pyrazin-4-yl)acetyl]amino]-2-hydroxy-4-phenylbutanoic acid Traditional Name: 3-[[2-(1-acetyl-3-keto-5-phenyl-2-sec-butyl-2H-pyrazin-4-yl)acetyl]amino]-2-hydroxy-4-phenyl-butyric acid Formula: C28H33N3O6 MolecularWeight: 507.57812

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1C(=O)N(C(=CN1C(=O)C)C2=CC=CC=C2)CC(=O)NC(CC3=CC=CC=C3)C(C(=O)O)O

Isomeric SMILES

CCC(C)C1C(=O)N(C(=CN1C(=O)C)C2=CC=CC=C2)CC(=O)NC(CC3=CC=CC=C3)C(C(=O)O)O

InChI

InChI=1S/C28H33N3O6/c1-4-18(2)25-27(35)31(23(16-30(25)19(3)32)21-13-9-6-10-14-21)17-24(33)29-22(26(34)28(36)37)15-20-11-7-5-8-12-20/h5-14,16,18,22,25-26,34H,4,15,17H2,1-3H3,(H,29,33)(H,36,37)