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

Systemtic Name: 3-[2-(2-cyclohexyl-1-ethanoyl-3-oxidanylidene-5-phenyl-2H-pyrazin-4-yl)ethanoylamino]-2-oxidanylidene-4-phenyl-butanoic acid Openeye Name: 3-[[2-(1-acetyl-2-cyclohexyl-3-oxo-5-phenyl-2H-pyrazin-4-yl)acetyl]amino]-2-oxo-4-phenyl-butanoic acid CAS Name: 3-[[2-(1-acetyl-2-cyclohexyl-3-oxo-5-phenyl-2H-pyrazin-4-yl)-1-oxoethyl]amino]-2-oxo-4-phenylbutanoic acid IUPAC Name: 3-[[2-(1-acetyl-2-cyclohexyl-3-oxo-5-phenyl-2H-pyrazin-4-yl)acetyl]amino]-2-oxo-4-phenylbutanoic acid Traditional Name: 3-[[2-(1-acetyl-2-cyclohexyl-3-keto-5-phenyl-2H-pyrazin-4-yl)acetyl]amino]-2-keto-4-phenyl-butyric acid Formula: C30H33N3O6 MolecularWeight: 531.59952

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=C(N(C(=O)C1C2CCCCC2)CC(=O)NC(CC3=CC=CC=C3)C(=O)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N1C=C(N(C(=O)C1C2CCCCC2)CC(=O)NC(CC3=CC=CC=C3)C(=O)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C30H33N3O6/c1-20(34)32-18-25(22-13-7-3-8-14-22)33(29(37)27(32)23-15-9-4-10-16-23)19-26(35)31-24(28(36)30(38)39)17-21-11-5-2-6-12-21/h2-3,5-8,11-14,18,23-24,27H,4,9-10,15-17,19H2,1H3,(H,31,35)(H,38,39)