[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl] 3-azanylpyrazine-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl] 3-azanylpyrazine-2-carboxylate Openeye Name: [2-(4-isopropylanilino)-2-oxo-ethyl] 3-aminopyrazine-2-carboxylate CAS Name: 3-amino-2-pyrazinecarboxylic acid [2-oxo-2-(4-propan-2-ylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-propan-2-ylanilino)ethyl] 3-aminopyrazine-2-carboxylate Traditional Name: 3-aminopyrazinic acid (2-cumidino-2-keto-ethyl) ester Formula: C16H18N4O3 MolecularWeight: 314.33912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)COC(=O)C2=NC=CN=C2N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)COC(=O)C2=NC=CN=C2N

InChI

InChI=1S/C16H18N4O3/c1-10(2)11-3-5-12(6-4-11)20-13(21)9-23-16(22)14-15(17)19-8-7-18-14/h3-8,10H,9H2,1-2H3,(H2,17,19)(H,20,21)