[2-oxidanylidene-2-(4-phenylbutan-2-ylamino)ethyl] 3-azanylpyrazine-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(4-phenylbutan-2-ylamino)ethyl] 3-azanylpyrazine-2-carboxylate Openeye Name: [2-[(1-methyl-3-phenyl-propyl)amino]-2-oxo-ethyl] 3-aminopyrazine-2-carboxylate CAS Name: 3-amino-2-pyrazinecarboxylic acid [2-oxo-2-(4-phenylbutan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylbutan-2-ylamino)ethyl] 3-aminopyrazine-2-carboxylate Traditional Name: 3-aminopyrazinic acid [2-keto-2-[(1-methyl-3-phenyl-propyl)amino]ethyl] ester Formula: C17H20N4O3 MolecularWeight: 328.3657

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)COC(=O)C2=NC=CN=C2N

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)COC(=O)C2=NC=CN=C2N

InChI

InChI=1S/C17H20N4O3/c1-12(7-8-13-5-3-2-4-6-13)21-14(22)11-24-17(23)15-16(18)20-10-9-19-15/h2-6,9-10,12H,7-8,11H2,1H3,(H2,18,20)(H,21,22)