N-[3-(4-ethanoylpiperazin-1-yl)-3-oxidanylidene-propyl]-N-[(4-fluorophenyl)methyl]pyrazine-2-carboxamide

Systemtic Name: N-[3-(4-ethanoylpiperazin-1-yl)-3-oxidanylidene-propyl]-N-[(4-fluorophenyl)methyl]pyrazine-2-carboxamide Openeye Name: N-[3-(4-acetylpiperazin-1-yl)-3-oxo-propyl]-N-[(4-fluorophenyl)methyl]pyrazine-2-carboxamide CAS Name: N-[3-(4-acetyl-1-piperazinyl)-3-oxopropyl]-N-[(4-fluorophenyl)methyl]-2-pyrazinecarboxamide IUPAC Name: N-[3-(4-acetylpiperazin-1-yl)-3-oxopropyl]-N-[(4-fluorophenyl)methyl]pyrazine-2-carboxamide Traditional Name: N-[3-(4-acetylpiperazino)-3-keto-propyl]-N-(4-fluorobenzyl)pyrazinamide Formula: C21H24FN5O3 MolecularWeight: 413.445363

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)CCN(CC2=CC=C(C=C2)F)C(=O)C3=NC=CN=C3

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)CCN(CC2=CC=C(C=C2)F)C(=O)C3=NC=CN=C3

InChI

InChI=1S/C21H24FN5O3/c1-16(28)25-10-12-26(13-11-25)20(29)6-9-27(15-17-2-4-18(22)5-3-17)21(30)19-14-23-7-8-24-19/h2-5,7-8,14H,6,9-13,15H2,1H3