N-[(2S)-1-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-1-oxidanylidene-propan-2-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(2S)-1-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-1-oxidanylidene-propan-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1S)-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl]-4-methyl-benzenesulfonamide CAS Name: N-[(2S)-1-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]-1-oxopropan-2-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[(2S)-1-[4-(4-fluorobenzoyl)piperazin-1-yl]-1-oxopropan-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[(1S)-2-[4-(4-fluorobenzoyl)piperazino]-2-keto-1-methyl-ethyl]-4-methyl-benzenesulfonamide Formula: C21H24FN3O4S MolecularWeight: 433.496363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H24FN3O4S/c1-15-3-9-19(10-4-15)30(28,29)23-16(2)20(26)24-11-13-25(14-12-24)21(27)17-5-7-18(22)8-6-17/h3-10,16,23H,11-14H2,1-2H3/t16-/m0/s1