4-[[3-(2-methylpropyl)-2-[[(2R)-oxolan-2-yl]methylsulfonyl]imidazol-4-yl]methyl]piperazin-4-ium-2-one

Systemtic Name: 4-[[3-(2-methylpropyl)-2-[[(2R)-oxolan-2-yl]methylsulfonyl]imidazol-4-yl]methyl]piperazin-4-ium-2-one Openeye Name: 4-[[3-isobutyl-2-[[(2R)-tetrahydrofuran-2-yl]methylsulfonyl]imidazol-4-yl]methyl]piperazin-4-ium-2-one CAS Name: 4-[[3-(2-methylpropyl)-2-[[(2R)-2-oxolanyl]methylsulfonyl]-4-imidazolyl]methyl]-2-piperazin-4-iumone IUPAC Name: 4-[[3-(2-methylpropyl)-2-[[(2R)-oxolan-2-yl]methylsulfonyl]imidazol-4-yl]methyl]piperazin-4-ium-2-one Traditional Name: 4-[[3-isobutyl-2-[[(2R)-tetrahydrofuran-2-yl]methylsulfonyl]imidazol-4-yl]methyl]piperazin-4-ium-2-one Formula: C17H29N4O4S+ MolecularWeight: 385.50156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CN=C1S(=O)(=O)CC2CCCO2)C[NH+]3CCNC(=O)C3

Isomeric SMILES

CC(C)CN1C(=CN=C1S(=O)(=O)C[C@H]2CCCO2)C[NH+]3CCNC(=O)C3

InChI

InChI=1S/C17H28N4O4S/c1-13(2)9-21-14(10-20-6-5-18-16(22)11-20)8-19-17(21)26(23,24)12-15-4-3-7-25-15/h8,13,15H,3-7,9-12H2,1-2H3,(H,18,22)/p+1/t15-/m1/s1