[2-oxidanylidene-2-[[2-(1-phenylethylcarbamoyl)phenyl]amino]ethyl] 3-azanylpyrazine-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[2-(1-phenylethylcarbamoyl)phenyl]amino]ethyl] 3-azanylpyrazine-2-carboxylate Openeye Name: [2-oxo-2-[2-(1-phenylethylcarbamoyl)anilino]ethyl] 3-aminopyrazine-2-carboxylate CAS Name: 3-amino-2-pyrazinecarboxylic acid [2-oxo-2-[2-[oxo-(1-phenylethylamino)methyl]anilino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(1-phenylethylcarbamoyl)anilino]ethyl] 3-aminopyrazine-2-carboxylate Traditional Name: 3-aminopyrazinic acid [2-keto-2-[2-(1-phenylethylcarbamoyl)anilino]ethyl] ester Formula: C22H21N5O4 MolecularWeight: 419.43324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=NC=CN=C3N

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=NC=CN=C3N

InChI

InChI=1S/C22H21N5O4/c1-14(15-7-3-2-4-8-15)26-21(29)16-9-5-6-10-17(16)27-18(28)13-31-22(30)19-20(23)25-12-11-24-19/h2-12,14H,13H2,1H3,(H2,23,25)(H,26,29)(H,27,28)