1-[2-[3-(4-chlorophenyl)-4-pyrimidin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-3-methyl-2-oxidanyl-butan-1-one

Systemtic Name: 1-[2-[3-(4-chlorophenyl)-4-pyrimidin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-3-methyl-2-oxidanyl-butan-1-one Openeye Name: 1-[2-[3-(4-chlorophenyl)-4-pyrimidin-4-yl-1H-pyrazol-5-yl]-1-piperidyl]-2-hydroxy-3-methyl-butan-1-one CAS Name: 1-[2-[3-(4-chlorophenyl)-4-(4-pyrimidinyl)-1H-pyrazol-5-yl]-1-piperidinyl]-2-hydroxy-3-methyl-1-butanone IUPAC Name: 1-[2-[3-(4-chlorophenyl)-4-pyrimidin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-2-hydroxy-3-methylbutan-1-one Traditional Name: 1-[2-[3-(4-chlorophenyl)-4-(4-pyrimidyl)-1H-pyrazol-5-yl]piperidino]-2-hydroxy-3-methyl-butan-1-one Formula: C23H26ClN5O2 MolecularWeight: 439.93784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCCCC1C2=C(C(=NN2)C3=CC=C(C=C3)Cl)C4=NC=NC=C4)O

Isomeric SMILES

CC(C)C(C(=O)N1CCCCC1C2=C(C(=NN2)C3=CC=C(C=C3)Cl)C4=NC=NC=C4)O

InChI

InChI=1S/C23H26ClN5O2/c1-14(2)22(30)23(31)29-12-4-3-5-18(29)21-19(17-10-11-25-13-26-17)20(27-28-21)15-6-8-16(24)9-7-15/h6-11,13-14,18,22,30H,3-5,12H2,1-2H3,(H,27,28)