[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]-(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methanone

Systemtic Name: [4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]-(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methanone Openeye Name: [4-[(2-chloro-4-fluoro-phenyl)methyl]piperazin-1-yl]-(5-pyrrolidin-1-ylsulfonyl-2-furyl)methanone CAS Name: [4-[(2-chloro-4-fluorophenyl)methyl]-1-piperazinyl]-[5-(1-pyrrolidinylsulfonyl)-2-furanyl]methanone IUPAC Name: [4-[(2-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methanone Traditional Name: [4-(2-chloro-4-fluoro-benzyl)piperazino]-(5-pyrrolidinosulfonyl-2-furyl)methanone Formula: C20H23ClFN3O4S MolecularWeight: 455.930723

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(O2)C(=O)N3CCN(CC3)CC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(O2)C(=O)N3CCN(CC3)CC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C20H23ClFN3O4S/c21-17-13-16(22)4-3-15(17)14-23-9-11-24(12-10-23)20(26)18-5-6-19(29-18)30(27,28)25-7-1-2-8-25/h3-6,13H,1-2,7-12,14H2