4-[4-[2,5-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]-2-methyl-6-pyrazol-1-yl-pyrimidine

Systemtic Name: 4-[4-[2,5-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]-2-methyl-6-pyrazol-1-yl-pyrimidine Openeye Name: 4-[4-(2,5-difluorophenyl)sulfonylpiperazin-1-yl]-2-methyl-6-pyrazol-1-yl-pyrimidine CAS Name: 4-[4-(2,5-difluorophenyl)sulfonyl-1-piperazinyl]-2-methyl-6-(1-pyrazolyl)pyrimidine IUPAC Name: 4-[4-(2,5-difluorophenyl)sulfonylpiperazin-1-yl]-2-methyl-6-pyrazol-1-ylpyrimidine Traditional Name: 4-[4-(2,5-difluorophenyl)sulfonylpiperazino]-2-methyl-6-pyrazol-1-yl-pyrimidine Formula: C18H18F2N6O2S MolecularWeight: 420.436326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)F)F)N4C=CC=N4

Isomeric SMILES

CC1=NC(=CC(=N1)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)F)F)N4C=CC=N4

InChI

InChI=1S/C18H18F2N6O2S/c1-13-22-17(12-18(23-13)26-6-2-5-21-26)24-7-9-25(10-8-24)29(27,28)16-11-14(19)3-4-15(16)20/h2-6,11-12H,7-10H2,1H3