N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-5-(piperidin-1-ylmethyl)furan-2-carboxamide

Systemtic Name: N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-5-(piperidin-1-ylmethyl)furan-2-carboxamide Openeye Name: N-[1-[(2-chloro-6-fluoro-phenyl)methyl]pyrazol-3-yl]-5-(1-piperidylmethyl)furan-2-carboxamide CAS Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]-3-pyrazolyl]-5-(1-piperidinylmethyl)-2-furancarboxamide IUPAC Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-3-yl]-5-(piperidin-1-ylmethyl)furan-2-carboxamide Traditional Name: N-[1-(2-chloro-6-fluoro-benzyl)pyrazol-3-yl]-5-(piperidinomethyl)-2-furamide Formula: C21H22ClFN4O2 MolecularWeight: 416.876383

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(O2)C(=O)NC3=NN(C=C3)CC4=C(C=CC=C4Cl)F

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(O2)C(=O)NC3=NN(C=C3)CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C21H22ClFN4O2/c22-17-5-4-6-18(23)16(17)14-27-12-9-20(25-27)24-21(28)19-8-7-15(29-19)13-26-10-2-1-3-11-26/h4-9,12H,1-3,10-11,13-14H2,(H,24,25,28)