2-[methyl-[3-[naphthalen-2-ylmethyl-(3-oxidanylidene-3-pyrimidin-2-yl-propanoyl)amino]phenyl]carbonyl-amino]ethanoic acid

Systemtic Name: 2-[methyl-[3-[naphthalen-2-ylmethyl-(3-oxidanylidene-3-pyrimidin-2-yl-propanoyl)amino]phenyl]carbonyl-amino]ethanoic acid Openeye Name: 2-[methyl-[3-[2-naphthylmethyl-(3-oxo-3-pyrimidin-2-yl-propanoyl)amino]benzoyl]amino]acetic acid CAS Name: 2-[[[3-[[1,3-dioxo-3-(2-pyrimidinyl)propyl]-(2-naphthalenylmethyl)amino]phenyl]-oxomethyl]-methylamino]acetic acid IUPAC Name: 2-[methyl-[3-[naphthalen-2-ylmethyl-(3-oxo-3-pyrimidin-2-ylpropanoyl)amino]benzoyl]amino]acetic acid Traditional Name: 2-[[3-[[3-keto-3-(2-pyrimidyl)propanoyl]-(2-naphthylmethyl)amino]benzoyl]-methyl-amino]acetic acid Formula: C28H24N4O5 MolecularWeight: 496.51396

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=O)C1=CC(=CC=C1)N(CC2=CC3=CC=CC=C3C=C2)C(=O)CC(=O)C4=NC=CC=N4

Isomeric SMILES

CN(CC(=O)O)C(=O)C1=CC(=CC=C1)N(CC2=CC3=CC=CC=C3C=C2)C(=O)CC(=O)C4=NC=CC=N4

InChI

InChI=1S/C28H24N4O5/c1-31(18-26(35)36)28(37)22-8-4-9-23(15-22)32(25(34)16-24(33)27-29-12-5-13-30-27)17-19-10-11-20-6-2-3-7-21(20)14-19/h2-15H,16-18H2,1H3,(H,35,36)