2-[4-[(2S)-butan-2-yl]phenoxy]-N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]ethanamide

Systemtic Name: 2-[4-[(2S)-butan-2-yl]phenoxy]-N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]ethanamide Openeye Name: 2-[4-[(1S)-1-methylpropyl]phenoxy]-N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]acetamide CAS Name: 2-[4-[(2S)-butan-2-yl]phenoxy]-N-[4-(4-methylsulfonyl-1-piperazinyl)phenyl]acetamide IUPAC Name: 2-[4-[(2S)-butan-2-yl]phenoxy]-N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]acetamide Traditional Name: N-[4-(4-mesylpiperazino)phenyl]-2-[4-[(1S)-1-methylpropyl]phenoxy]acetamide Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OCC(=O)NC2=CC=C(C=C2)N3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)OCC(=O)NC2=CC=C(C=C2)N3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C23H31N3O4S/c1-4-18(2)19-5-11-22(12-6-19)30-17-23(27)24-20-7-9-21(10-8-20)25-13-15-26(16-14-25)31(3,28)29/h5-12,18H,4,13-17H2,1-3H3,(H,24,27)/t18-/m0/s1