1-[(3-methoxyphenyl)methyl]-4-[[3-(2-methylpropyl)-2-methylsulfonyl-imidazol-4-yl]methyl]piperazin-2-one

Systemtic Name: 1-[(3-methoxyphenyl)methyl]-4-[[3-(2-methylpropyl)-2-methylsulfonyl-imidazol-4-yl]methyl]piperazin-2-one Openeye Name: 4-[(3-isobutyl-2-methylsulfonyl-imidazol-4-yl)methyl]-1-[(3-methoxyphenyl)methyl]piperazin-2-one CAS Name: 1-[(3-methoxyphenyl)methyl]-4-[[3-(2-methylpropyl)-2-methylsulfonyl-4-imidazolyl]methyl]-2-piperazinone IUPAC Name: 1-[(3-methoxyphenyl)methyl]-4-[[3-(2-methylpropyl)-2-methylsulfonylimidazol-4-yl]methyl]piperazin-2-one Traditional Name: 4-[(3-isobutyl-2-mesyl-imidazol-4-yl)methyl]-1-m-anisyl-piperazin-2-one Formula: C21H30N4O4S MolecularWeight: 434.5523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CN=C1S(=O)(=O)C)CN2CCN(C(=O)C2)CC3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)CN1C(=CN=C1S(=O)(=O)C)CN2CCN(C(=O)C2)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H30N4O4S/c1-16(2)12-25-18(11-22-21(25)30(4,27)28)14-23-8-9-24(20(26)15-23)13-17-6-5-7-19(10-17)29-3/h5-7,10-11,16H,8-9,12-15H2,1-4H3