[1-[4-(4-fluorophenyl)-5-methyl-pyrimidin-2-yl]-5-propan-2-yl-pyrazol-4-yl]-(4-propan-2-ylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [1-[4-(4-fluorophenyl)-5-methyl-pyrimidin-2-yl]-5-propan-2-yl-pyrazol-4-yl]-(4-propan-2-ylpiperazin-4-ium-1-yl)methanone Openeye Name: [1-[4-(4-fluorophenyl)-5-methyl-pyrimidin-2-yl]-5-isopropyl-pyrazol-4-yl]-(4-isopropylpiperazin-4-ium-1-yl)methanone CAS Name: [1-[4-(4-fluorophenyl)-5-methyl-2-pyrimidinyl]-5-propan-2-yl-4-pyrazolyl]-(4-propan-2-yl-1-piperazin-4-iumyl)methanone IUPAC Name: [1-[4-(4-fluorophenyl)-5-methylpyrimidin-2-yl]-5-propan-2-ylpyrazol-4-yl]-(4-propan-2-ylpiperazin-4-ium-1-yl)methanone Traditional Name: [1-[4-(4-fluorophenyl)-5-methyl-pyrimidin-2-yl]-5-isopropyl-pyrazol-4-yl]-(4-isopropylpiperazin-4-ium-1-yl)methanone Formula: C25H32FN6O+ MolecularWeight: 451.559583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1C2=CC=C(C=C2)F)N3C(=C(C=N3)C(=O)N4CC[NH+](CC4)C(C)C)C(C)C

Isomeric SMILES

CC1=CN=C(N=C1C2=CC=C(C=C2)F)N3C(=C(C=N3)C(=O)N4CC[NH+](CC4)C(C)C)C(C)C

InChI

InChI=1S/C25H31FN6O/c1-16(2)23-21(24(33)31-12-10-30(11-13-31)17(3)4)15-28-32(23)25-27-14-18(5)22(29-25)19-6-8-20(26)9-7-19/h6-9,14-17H,10-13H2,1-5H3/p+1