4-(3-fluorophenyl)sulfonyl-N-(2-phenylbutyl)piperazine-1-carboxamide

Systemtic Name: 4-(3-fluorophenyl)sulfonyl-N-(2-phenylbutyl)piperazine-1-carboxamide Openeye Name: 4-(3-fluorophenyl)sulfonyl-N-(2-phenylbutyl)piperazine-1-carboxamide CAS Name: 4-(3-fluorophenyl)sulfonyl-N-(2-phenylbutyl)-1-piperazinecarboxamide IUPAC Name: 4-(3-fluorophenyl)sulfonyl-N-(2-phenylbutyl)piperazine-1-carboxamide Traditional Name: 4-(3-fluorophenyl)sulfonyl-N-(2-phenylbutyl)piperazine-1-carboxamide Formula: C21H26FN3O3S MolecularWeight: 419.512843

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)F)C3=CC=CC=C3

Isomeric SMILES

CCC(CNC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)F)C3=CC=CC=C3

InChI

InChI=1S/C21H26FN3O3S/c1-2-17(18-7-4-3-5-8-18)16-23-21(26)24-11-13-25(14-12-24)29(27,28)20-10-6-9-19(22)15-20/h3-10,15,17H,2,11-14,16H2,1H3,(H,23,26)