1-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-4-methyl-pentan-1-one

Systemtic Name: 1-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-4-methyl-pentan-1-one Openeye Name: 1-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-4-methyl-pentan-1-one CAS Name: 1-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-4-methyl-1-pentanone IUPAC Name: 1-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-4-methylpentan-1-one Traditional Name: 1-[4-(2,5-dimethylphenyl)sulfonylpiperazino]-4-methyl-pentan-1-one Formula: C18H28N2O3S MolecularWeight: 352.49152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CCC(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CCC(C)C

InChI

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