2-[2-(5-acetamido-6-oxidanylidene-2-phenyl-pyrimidin-1-yl)ethanoylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[2-(5-acetamido-6-oxidanylidene-2-phenyl-pyrimidin-1-yl)ethanoylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-(5-acetamido-6-oxo-2-phenyl-pyrimidin-1-yl)acetyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[2-(5-acetamido-6-oxo-2-phenyl-1-pyrimidinyl)-1-oxoethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-(5-acetamido-6-oxo-2-phenylpyrimidin-1-yl)acetyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[2-(5-acetamido-6-keto-2-phenyl-pyrimidin-1-yl)acetyl]amino]-3-phenyl-propionic acid Formula: C23H22N4O5 MolecularWeight: 434.44458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CN=C(N(C1=O)CC(=O)NC(CC2=CC=CC=C2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=CN=C(N(C1=O)CC(=O)NC(CC2=CC=CC=C2)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C23H22N4O5/c1-15(28)25-19-13-24-21(17-10-6-3-7-11-17)27(22(19)30)14-20(29)26-18(23(31)32)12-16-8-4-2-5-9-16/h2-11,13,18H,12,14H2,1H3,(H,25,28)(H,26,29)(H,31,32)