5-chloranyl-N-[2-(phenylmethyl)pyrazol-3-yl]-2-piperidin-1-yl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[2-(phenylmethyl)pyrazol-3-yl]-2-piperidin-1-yl-pyrimidine-4-carboxamide Openeye Name: N-(2-benzylpyrazol-3-yl)-5-chloro-2-(1-piperidyl)pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[2-(phenylmethyl)-3-pyrazolyl]-2-(1-piperidinyl)-4-pyrimidinecarboxamide IUPAC Name: N-(2-benzylpyrazol-3-yl)-5-chloro-2-piperidin-1-ylpyrimidine-4-carboxamide Traditional Name: N-(2-benzylpyrazol-3-yl)-5-chloro-2-piperidino-pyrimidine-4-carboxamide Formula: C20H21ClN6O MolecularWeight: 396.87334

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC=C(C(=N2)C(=O)NC3=CC=NN3CC4=CC=CC=C4)Cl

Isomeric SMILES

C1CCN(CC1)C2=NC=C(C(=N2)C(=O)NC3=CC=NN3CC4=CC=CC=C4)Cl

InChI

InChI=1S/C20H21ClN6O/c21-16-13-22-20(26-11-5-2-6-12-26)25-18(16)19(28)24-17-9-10-23-27(17)14-15-7-3-1-4-8-15/h1,3-4,7-10,13H,2,5-6,11-12,14H2,(H,24,28)