4-(4-fluorophenyl)-1,2-dimethyl-5-[2-[(1-propylsulfonylpiperidin-4-yl)amino]pyrimidin-4-yl]pyrazol-3-one

Systemtic Name: 4-(4-fluorophenyl)-1,2-dimethyl-5-[2-[(1-propylsulfonylpiperidin-4-yl)amino]pyrimidin-4-yl]pyrazol-3-one Openeye Name: 4-(4-fluorophenyl)-1,2-dimethyl-5-[2-[(1-propylsulfonyl-4-piperidyl)amino]pyrimidin-4-yl]pyrazol-3-one CAS Name: 4-(4-fluorophenyl)-1,2-dimethyl-5-[2-[(1-propylsulfonyl-4-piperidinyl)amino]-4-pyrimidinyl]-3-pyrazolone IUPAC Name: 4-(4-fluorophenyl)-1,2-dimethyl-5-[2-[(1-propylsulfonylpiperidin-4-yl)amino]pyrimidin-4-yl]pyrazol-3-one Traditional Name: 4-(4-fluorophenyl)-1,2-dimethyl-5-[2-[(1-propylsulfonyl-4-piperidyl)amino]pyrimidin-4-yl]-3-pyrazolin-3-one Formula: C23H29FN6O3S MolecularWeight: 488.578163

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCC(CC1)NC2=NC=CC(=N2)C3=C(C(=O)N(N3C)C)C4=CC=C(C=C4)F

Isomeric SMILES

CCCS(=O)(=O)N1CCC(CC1)NC2=NC=CC(=N2)C3=C(C(=O)N(N3C)C)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H29FN6O3S/c1-4-15-34(32,33)30-13-10-18(11-14-30)26-23-25-12-9-19(27-23)21-20(22(31)29(3)28(21)2)16-5-7-17(24)8-6-16/h5-9,12,18H,4,10-11,13-15H2,1-3H3,(H,25,26,27)