(2S)-2-phenoxy-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: (2S)-2-phenoxy-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: (2S)-2-phenoxy-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propan-1-one CAS Name: (2S)-2-phenoxy-1-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: (2S)-2-phenoxy-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: (2S)-1-(4-mesitylsulfonylpiperazino)-2-phenoxy-propan-1-one Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C(C)OC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)[C@H](C)OC3=CC=CC=C3)C

InChI

InChI=1S/C22H28N2O4S/c1-16-14-17(2)21(18(3)15-16)29(26,27)24-12-10-23(11-13-24)22(25)19(4)28-20-8-6-5-7-9-20/h5-9,14-15,19H,10-13H2,1-4H3/t19-/m0/s1