cyclopropyl-[(4-fluorophenyl)methyl]-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]azanium

Systemtic Name: cyclopropyl-[(4-fluorophenyl)methyl]-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]azanium Openeye Name: cyclopropyl-[(4-fluorophenyl)methyl]-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]ammonium CAS Name: cyclopropyl-[(4-fluorophenyl)methyl]-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]ammonium IUPAC Name: cyclopropyl-[(4-fluorophenyl)methyl]-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]azanium Traditional Name: cyclopropyl-(4-fluorobenzyl)-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl]ammonium Formula: C20H25FN5O+ MolecularWeight: 370.443803

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1[NH+](CC2=CC=C(C=C2)F)CC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1CC1[NH+](CC2=CC=C(C=C2)F)CC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C20H24FN5O/c21-17-4-2-16(3-5-17)14-26(18-6-7-18)15-19(27)24-10-12-25(13-11-24)20-22-8-1-9-23-20/h1-5,8-9,18H,6-7,10-15H2/p+1