4-[5-cyclopropyl-1-[4-(3-fluoranyl-4-methoxy-phenyl)pyrimidin-2-yl]pyrazol-4-yl]carbonylpiperazine-1-carbaldehyde

Systemtic Name: 4-[5-cyclopropyl-1-[4-(3-fluoranyl-4-methoxy-phenyl)pyrimidin-2-yl]pyrazol-4-yl]carbonylpiperazine-1-carbaldehyde Openeye Name: 4-[5-cyclopropyl-1-[4-(3-fluoro-4-methoxy-phenyl)pyrimidin-2-yl]pyrazole-4-carbonyl]piperazine-1-carbaldehyde CAS Name: 4-[[5-cyclopropyl-1-[4-(3-fluoro-4-methoxyphenyl)-2-pyrimidinyl]-4-pyrazolyl]-oxomethyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[5-cyclopropyl-1-[4-(3-fluoro-4-methoxyphenyl)pyrimidin-2-yl]pyrazole-4-carbonyl]piperazine-1-carbaldehyde Traditional Name: 4-[5-cyclopropyl-1-[4-(3-fluoro-4-methoxy-phenyl)pyrimidin-2-yl]pyrazole-4-carbonyl]piperazine-1-carbaldehyde Formula: C23H23FN6O3 MolecularWeight: 450.465523

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)N4CCN(CC4)C=O)C5CC5)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)N4CCN(CC4)C=O)C5CC5)F

InChI

InChI=1S/C23H23FN6O3/c1-33-20-5-4-16(12-18(20)24)19-6-7-25-23(27-19)30-21(15-2-3-15)17(13-26-30)22(32)29-10-8-28(14-31)9-11-29/h4-7,12-15H,2-3,8-11H2,1H3