(3-cyclopropyl-1H-pyrazol-5-yl)methyl-methyl-[[3-(3-methylbutyl)-2-propan-2-ylsulfonyl-imidazol-4-yl]methyl]azanium

Systemtic Name: (3-cyclopropyl-1H-pyrazol-5-yl)methyl-methyl-[[3-(3-methylbutyl)-2-propan-2-ylsulfonyl-imidazol-4-yl]methyl]azanium Openeye Name: (3-cyclopropyl-1H-pyrazol-5-yl)methyl-[(3-isopentyl-2-isopropylsulfonyl-imidazol-4-yl)methyl]-methyl-ammonium CAS Name: (3-cyclopropyl-1H-pyrazol-5-yl)methyl-methyl-[[3-(3-methylbutyl)-2-propan-2-ylsulfonyl-4-imidazolyl]methyl]ammonium IUPAC Name: (3-cyclopropyl-1H-pyrazol-5-yl)methyl-methyl-[[3-(3-methylbutyl)-2-propan-2-ylsulfonylimidazol-4-yl]methyl]azanium Traditional Name: (3-cyclopropyl-1H-pyrazol-5-yl)methyl-[(3-isoamyl-2-isopropylsulfonyl-imidazol-4-yl)methyl]-methyl-ammonium Formula: C20H34N5O2S+ MolecularWeight: 408.58126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=CN=C1S(=O)(=O)C(C)C)C[NH+](C)CC2=CC(=NN2)C3CC3

Isomeric SMILES

CC(C)CCN1C(=CN=C1S(=O)(=O)C(C)C)C[NH+](C)CC2=CC(=NN2)C3CC3

InChI

InChI=1S/C20H33N5O2S/c1-14(2)8-9-25-18(11-21-20(25)28(26,27)15(3)4)13-24(5)12-17-10-19(23-22-17)16-6-7-16/h10-11,14-16H,6-9,12-13H2,1-5H3,(H,22,23)/p+1