N-[2-[[2,3-bis(chloranyl)phenyl]methyl]pyrazol-3-yl]-1-pyrimidin-2-yl-piperidine-4-carboxamide

Systemtic Name: N-[2-[[2,3-bis(chloranyl)phenyl]methyl]pyrazol-3-yl]-1-pyrimidin-2-yl-piperidine-4-carboxamide Openeye Name: N-[2-[(2,3-dichlorophenyl)methyl]pyrazol-3-yl]-1-pyrimidin-2-yl-piperidine-4-carboxamide CAS Name: N-[2-[(2,3-dichlorophenyl)methyl]-3-pyrazolyl]-1-(2-pyrimidinyl)-4-piperidinecarboxamide IUPAC Name: N-[2-[(2,3-dichlorophenyl)methyl]pyrazol-3-yl]-1-pyrimidin-2-ylpiperidine-4-carboxamide Traditional Name: N-[2-(2,3-dichlorobenzyl)pyrazol-3-yl]-1-(2-pyrimidyl)isonipecotamide Formula: C20H20Cl2N6O MolecularWeight: 431.3184

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=NN2CC3=C(C(=CC=C3)Cl)Cl)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=NN2CC3=C(C(=CC=C3)Cl)Cl)C4=NC=CC=N4

InChI

InChI=1S/C20H20Cl2N6O/c21-16-4-1-3-15(18(16)22)13-28-17(5-10-25-28)26-19(29)14-6-11-27(12-7-14)20-23-8-2-9-24-20/h1-5,8-10,14H,6-7,11-13H2,(H,26,29)