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

Systemtic Name: N-butyl-N-[3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]pyrazine-2-carboxamide Openeye Name: N-butyl-N-[3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxo-propyl]pyrazine-2-carboxamide CAS Name: N-butyl-N-[3-[4-(2-fluorophenyl)-1-piperazinyl]-3-oxopropyl]-2-pyrazinecarboxamide IUPAC Name: N-butyl-N-[3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl]pyrazine-2-carboxamide Traditional Name: N-butyl-N-[3-[4-(2-fluorophenyl)piperazino]-3-keto-propyl]pyrazinamide Formula: C22H28FN5O2 MolecularWeight: 413.488423

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCC(=O)N1CCN(CC1)C2=CC=CC=C2F)C(=O)C3=NC=CN=C3

Isomeric SMILES

CCCCN(CCC(=O)N1CCN(CC1)C2=CC=CC=C2F)C(=O)C3=NC=CN=C3

InChI

InChI=1S/C22H28FN5O2/c1-2-3-11-28(22(30)19-17-24-9-10-25-19)12-8-21(29)27-15-13-26(14-16-27)20-7-5-4-6-18(20)23/h4-7,9-10,17H,2-3,8,11-16H2,1H3