1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-(1-ethylpyrazol-4-yl)sulfonyl-piperazine

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-(1-ethylpyrazol-4-yl)sulfonyl-piperazine Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methyl]-4-(1-ethylpyrazol-4-yl)sulfonyl-piperazine CAS Name: 1-[(2-chloro-6-fluorophenyl)methyl]-4-[(1-ethyl-4-pyrazolyl)sulfonyl]piperazine IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methyl]-4-(1-ethylpyrazol-4-yl)sulfonylpiperazine Traditional Name: 1-(2-chloro-6-fluoro-benzyl)-4-(1-ethylpyrazol-4-yl)sulfonyl-piperazine Formula: C16H20ClFN4O2S MolecularWeight: 386.872003

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)S(=O)(=O)N2CCN(CC2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CCN1C=C(C=N1)S(=O)(=O)N2CCN(CC2)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C16H20ClFN4O2S/c1-2-21-11-13(10-19-21)25(23,24)22-8-6-20(7-9-22)12-14-15(17)4-3-5-16(14)18/h3-5,10-11H,2,6-9,12H2,1H3