1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-4-(1,5-dimethylpyrazol-4-yl)sulfonyl-piperazine

Systemtic Name: 1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-4-(1,5-dimethylpyrazol-4-yl)sulfonyl-piperazine Openeye Name: 1-[(2-chloro-4-fluoro-phenyl)methyl]-4-(1,5-dimethylpyrazol-4-yl)sulfonyl-piperazine CAS Name: 1-[(2-chloro-4-fluorophenyl)methyl]-4-[(1,5-dimethyl-4-pyrazolyl)sulfonyl]piperazine IUPAC Name: 1-[(2-chloro-4-fluorophenyl)methyl]-4-(1,5-dimethylpyrazol-4-yl)sulfonylpiperazine Traditional Name: 1-(2-chloro-4-fluoro-benzyl)-4-(1,5-dimethylpyrazol-4-yl)sulfonyl-piperazine Formula: C16H20ClFN4O2S MolecularWeight: 386.872003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)S(=O)(=O)N2CCN(CC2)CC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CC1=C(C=NN1C)S(=O)(=O)N2CCN(CC2)CC3=C(C=C(C=C3)F)Cl

InChI

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