2-methyl-1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]butan-1-one

Systemtic Name: 2-methyl-1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]butan-1-one Openeye Name: 1-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]-2-methyl-butan-1-one CAS Name: 2-methyl-1-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]-1-butanone IUPAC Name: 2-methyl-1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]butan-1-one Traditional Name: 2-methyl-1-(4-p-cumenylsulfonylpiperazino)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=CC=C(C=C2)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C18H28N2O3S/c1-5-15(4)18(21)19-10-12-20(13-11-19)24(22,23)17-8-6-16(7-9-17)14(2)3/h6-9,14-15H,5,10-13H2,1-4H3