[2-oxidanylidene-2-[[2-[(phenylmethyl)carbamoyl]phenyl]amino]ethyl] pyrazine-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[2-[(phenylmethyl)carbamoyl]phenyl]amino]ethyl] pyrazine-2-carboxylate Openeye Name: [2-[2-(benzylcarbamoyl)anilino]-2-oxo-ethyl] pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [2-oxo-2-[2-[oxo-[(phenylmethyl)amino]methyl]anilino]ethyl] ester IUPAC Name: [2-[2-(benzylcarbamoyl)anilino]-2-oxoethyl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid [2-[2-(benzylcarbamoyl)anilino]-2-keto-ethyl] ester Formula: C21H18N4O4 MolecularWeight: 390.39202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N4O4/c26-19(14-29-21(28)18-13-22-10-11-23-18)25-17-9-5-4-8-16(17)20(27)24-12-15-6-2-1-3-7-15/h1-11,13H,12,14H2,(H,24,27)(H,25,26)