(2S)-2-methyl-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]butan-1-one

Systemtic Name: (2S)-2-methyl-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]butan-1-one Openeye Name: (2S)-2-methyl-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]butan-1-one CAS Name: (2S)-2-methyl-1-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]-1-butanone IUPAC Name: (2S)-2-methyl-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]butan-1-one Traditional Name: (2S)-1-(4-mesitylsulfonylpiperazino)-2-methyl-butan-1-one Formula: C18H28N2O3S MolecularWeight: 352.49152

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2C)C)C

Isomeric SMILES

CC[C@H](C)C(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2C)C)C

InChI

InChI=1S/C18H28N2O3S/c1-6-14(3)18(21)19-7-9-20(10-8-19)24(22,23)17-15(4)11-13(2)12-16(17)5/h11-12,14H,6-10H2,1-5H3/t14-/m0/s1