N-[(2S)-2-(4-ethanoylpiperazin-1-yl)-2-phenyl-ethyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(2S)-2-(4-ethanoylpiperazin-1-yl)-2-phenyl-ethyl]-4-methyl-benzenesulfonamide Openeye Name: N-[(2S)-2-(4-acetylpiperazin-1-yl)-2-phenyl-ethyl]-4-methyl-benzenesulfonamide CAS Name: N-[(2S)-2-(4-acetyl-1-piperazinyl)-2-phenylethyl]-4-methylbenzenesulfonamide IUPAC Name: N-[(2S)-2-(4-acetylpiperazin-1-yl)-2-phenylethyl]-4-methylbenzenesulfonamide Traditional Name: N-[(2S)-2-(4-acetylpiperazino)-2-phenyl-ethyl]-4-methyl-benzenesulfonamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC(C2=CC=CC=C2)N3CCN(CC3)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC[C@H](C2=CC=CC=C2)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C21H27N3O3S/c1-17-8-10-20(11-9-17)28(26,27)22-16-21(19-6-4-3-5-7-19)24-14-12-23(13-15-24)18(2)25/h3-11,21-22H,12-16H2,1-2H3/t21-/m1/s1