[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone

Systemtic Name: [4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone Openeye Name: [4-[(2-chloro-6-fluoro-phenyl)methyl]piperazin-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone CAS Name: [4-[(2-chloro-6-fluorophenyl)methyl]-1-piperazinyl]-[4-(1-pyrrolidinylsulfonyl)phenyl]methanone IUPAC Name: [4-[(2-chloro-6-fluorophenyl)methyl]piperazin-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone Traditional Name: [4-(2-chloro-6-fluoro-benzyl)piperazino]-(4-pyrrolidinosulfonylphenyl)methanone Formula: C22H25ClFN3O3S MolecularWeight: 465.968603

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)CC4=C(C=CC=C4Cl)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C22H25ClFN3O3S/c23-20-4-3-5-21(24)19(20)16-25-12-14-26(15-13-25)22(28)17-6-8-18(9-7-17)31(29,30)27-10-1-2-11-27/h3-9H,1-2,10-16H2