N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-4-yl]-1-(1-methylpyrazol-4-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-4-yl]-1-(1-methylpyrazol-4-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[1-[(2-chloro-4-fluoro-phenyl)methyl]pyrazol-4-yl]-1-(1-methylpyrazol-4-yl)sulfonyl-piperidine-3-carboxamide CAS Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]-4-pyrazolyl]-1-[(1-methyl-4-pyrazolyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]pyrazol-4-yl]-1-(1-methylpyrazol-4-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[1-(2-chloro-4-fluoro-benzyl)pyrazol-4-yl]-1-(1-methylpyrazol-4-yl)sulfonyl-nipecotamide Formula: C20H22ClFN6O3S MolecularWeight: 480.943483

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CN(N=C3)CC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

CN1C=C(C=N1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CN(N=C3)CC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C20H22ClFN6O3S/c1-26-13-18(9-23-26)32(30,31)28-6-2-3-15(11-28)20(29)25-17-8-24-27(12-17)10-14-4-5-16(22)7-19(14)21/h4-5,7-9,12-13,15H,2-3,6,10-11H2,1H3,(H,25,29)