[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]-(4-iodanyl-2-methyl-pyrazol-3-yl)methanone

Systemtic Name: [4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]-(4-iodanyl-2-methyl-pyrazol-3-yl)methanone Openeye Name: [4-[(2-chloro-4-fluoro-phenyl)methyl]piperazin-1-yl]-(4-iodo-2-methyl-pyrazol-3-yl)methanone CAS Name: [4-[(2-chloro-4-fluorophenyl)methyl]-1-piperazinyl]-(4-iodo-2-methyl-3-pyrazolyl)methanone IUPAC Name: [4-[(2-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-(4-iodo-2-methylpyrazol-3-yl)methanone Traditional Name: [4-(2-chloro-4-fluoro-benzyl)piperazino]-(4-iodo-2-methyl-pyrazol-3-yl)methanone Formula: C16H17ClFIN4O MolecularWeight: 462.688253

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)I)C(=O)N2CCN(CC2)CC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CN1C(=C(C=N1)I)C(=O)N2CCN(CC2)CC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C16H17ClFIN4O/c1-21-15(14(19)9-20-21)16(24)23-6-4-22(5-7-23)10-11-2-3-12(18)8-13(11)17/h2-3,8-9H,4-7,10H2,1H3