dicyclopropylmethyl-methyl-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-imidazol-4-yl]methyl]azanium

Systemtic Name: dicyclopropylmethyl-methyl-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-imidazol-4-yl]methyl]azanium Openeye Name: (2-benzylsulfonyl-3-isobutyl-imidazol-4-yl)methyl-(dicyclopropylmethyl)-methyl-ammonium CAS Name: dicyclopropylmethyl-methyl-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-4-imidazolyl]methyl]ammonium IUPAC Name: [2-benzylsulfonyl-3-(2-methylpropyl)imidazol-4-yl]methyl-(dicyclopropylmethyl)-methylazanium Traditional Name: (2-benzylsulfonyl-3-isobutyl-imidazol-4-yl)methyl-(dicyclopropylmethyl)-methyl-ammonium Formula: C23H34N3O2S+ MolecularWeight: 416.59996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CN=C1S(=O)(=O)CC2=CC=CC=C2)C[NH+](C)C(C3CC3)C4CC4

Isomeric SMILES

CC(C)CN1C(=CN=C1S(=O)(=O)CC2=CC=CC=C2)C[NH+](C)C(C3CC3)C4CC4

InChI

InChI=1S/C23H33N3O2S/c1-17(2)14-26-21(15-25(3)22(19-9-10-19)20-11-12-20)13-24-23(26)29(27,28)16-18-7-5-4-6-8-18/h4-8,13,17,19-20,22H,9-12,14-16H2,1-3H3/p+1