[1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 3-azanylpyrazine-2-carboxylate

Systemtic Name: [1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 3-azanylpyrazine-2-carboxylate Openeye Name: [1-methyl-2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 3-aminopyrazine-2-carboxylate CAS Name: 3-amino-2-pyrazinecarboxylic acid [1-oxo-1-(4-phenyl-1-piperazinyl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-phenylpiperazin-1-yl)propan-2-yl] 3-aminopyrazine-2-carboxylate Traditional Name: 3-aminopyrazinic acid [2-keto-1-methyl-2-(4-phenylpiperazino)ethyl] ester Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)OC(=O)C3=NC=CN=C3N

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)OC(=O)C3=NC=CN=C3N

InChI

InChI=1S/C18H21N5O3/c1-13(26-18(25)15-16(19)21-8-7-20-15)17(24)23-11-9-22(10-12-23)14-5-3-2-4-6-14/h2-8,13H,9-12H2,1H3,(H2,19,21)