N-[(2S)-1-[3,5-bis(oxidanylidene)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(2S)-1-[3,5-bis(oxidanylidene)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1S)-2-(3,5-dioxopiperazin-1-yl)-1-methyl-2-oxo-ethyl]-4-methyl-benzenesulfonamide CAS Name: N-[(2S)-1-(3,5-dioxo-1-piperazinyl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[(2S)-1-(3,5-dioxopiperazin-1-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[(1S)-2-(3,5-diketopiperazino)-2-keto-1-methyl-ethyl]-4-methyl-benzenesulfonamide Formula: C14H17N3O5S MolecularWeight: 339.36688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)N2CC(=O)NC(=O)C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C)C(=O)N2CC(=O)NC(=O)C2

InChI

InChI=1S/C14H17N3O5S/c1-9-3-5-11(6-4-9)23(21,22)16-10(2)14(20)17-7-12(18)15-13(19)8-17/h3-6,10,16H,7-8H2,1-2H3,(H,15,18,19)/t10-/m0/s1