2-[4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]-N-(3-methylbutyl)ethanamide

Systemtic Name: 2-[4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]-N-(3-methylbutyl)ethanamide Openeye Name: N-isopentyl-2-[4-[4-[(1S)-1-methylpropyl]phenyl]sulfonylpiperazin-1-yl]acetamide CAS Name: 2-[4-[4-[(2S)-butan-2-yl]phenyl]sulfonyl-1-piperazinyl]-N-(3-methylbutyl)acetamide IUPAC Name: 2-[4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]-N-(3-methylbutyl)acetamide Traditional Name: N-isoamyl-2-[4-[4-[(1S)-1-methylpropyl]phenyl]sulfonylpiperazino]acetamide Formula: C21H35N3O3S MolecularWeight: 409.5859

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NCCC(C)C

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NCCC(C)C

InChI

InChI=1S/C21H35N3O3S/c1-5-18(4)19-6-8-20(9-7-19)28(26,27)24-14-12-23(13-15-24)16-21(25)22-11-10-17(2)3/h6-9,17-18H,5,10-16H2,1-4H3,(H,22,25)/t18-/m0/s1