4-[(2S)-butan-2-yl]-N-[2-(4-ethylpiperazin-1-yl)phenyl]benzenesulfonamide

Systemtic Name: 4-[(2S)-butan-2-yl]-N-[2-(4-ethylpiperazin-1-yl)phenyl]benzenesulfonamide Openeye Name: N-[2-(4-ethylpiperazin-1-yl)phenyl]-4-[(1S)-1-methylpropyl]benzenesulfonamide CAS Name: 4-[(2S)-butan-2-yl]-N-[2-(4-ethyl-1-piperazinyl)phenyl]benzenesulfonamide IUPAC Name: 4-[(2S)-butan-2-yl]-N-[2-(4-ethylpiperazin-1-yl)phenyl]benzenesulfonamide Traditional Name: N-[2-(4-ethylpiperazino)phenyl]-4-[(1S)-1-methylpropyl]benzenesulfonamide Formula: C22H31N3O2S MolecularWeight: 401.56544

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2N3CCN(CC3)CC

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2N3CCN(CC3)CC

InChI

InChI=1S/C22H31N3O2S/c1-4-18(3)19-10-12-20(13-11-19)28(26,27)23-21-8-6-7-9-22(21)25-16-14-24(5-2)15-17-25/h6-13,18,23H,4-5,14-17H2,1-3H3/t18-/m0/s1