N-[(2-fluorophenyl)methyl]-4-oxidanylidene-4-[4-(phenylsulfonyl)piperazin-1-yl]butanamide

Systemtic Name: N-[(2-fluorophenyl)methyl]-4-oxidanylidene-4-[4-(phenylsulfonyl)piperazin-1-yl]butanamide Openeye Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-N-[(2-fluorophenyl)methyl]-4-oxo-butanamide CAS Name: 4-[4-(benzenesulfonyl)-1-piperazinyl]-N-[(2-fluorophenyl)methyl]-4-oxobutanamide IUPAC Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-N-[(2-fluorophenyl)methyl]-4-oxobutanamide Traditional Name: 4-(4-besylpiperazino)-N-(2-fluorobenzyl)-4-keto-butyramide Formula: C21H24FN3O4S MolecularWeight: 433.496363

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC(=O)NCC2=CC=CC=C2F)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)CCC(=O)NCC2=CC=CC=C2F)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H24FN3O4S/c22-19-9-5-4-6-17(19)16-23-20(26)10-11-21(27)24-12-14-25(15-13-24)30(28,29)18-7-2-1-3-8-18/h1-9H,10-16H2,(H,23,26)