methyl-[[3-(3-methylbutyl)-2-propan-2-ylsulfonyl-imidazol-4-yl]methyl]-[(3-methyl-1,2-oxazol-5-yl)methyl]azanium

Systemtic Name: methyl-[[3-(3-methylbutyl)-2-propan-2-ylsulfonyl-imidazol-4-yl]methyl]-[(3-methyl-1,2-oxazol-5-yl)methyl]azanium Openeye Name: (3-isopentyl-2-isopropylsulfonyl-imidazol-4-yl)methyl-methyl-[(3-methylisoxazol-5-yl)methyl]ammonium CAS Name: methyl-[[3-(3-methylbutyl)-2-propan-2-ylsulfonyl-4-imidazolyl]methyl]-[(3-methyl-5-isoxazolyl)methyl]ammonium IUPAC Name: methyl-[[3-(3-methylbutyl)-2-propan-2-ylsulfonylimidazol-4-yl]methyl]-[(3-methyl-1,2-oxazol-5-yl)methyl]azanium Traditional Name: (3-isoamyl-2-isopropylsulfonyl-imidazol-4-yl)methyl-methyl-[(3-methylisoxazol-5-yl)methyl]ammonium Formula: C18H31N4O3S+ MolecularWeight: 383.52874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C[NH+](C)CC2=CN=C(N2CCC(C)C)S(=O)(=O)C(C)C

Isomeric SMILES

CC1=NOC(=C1)C[NH+](C)CC2=CN=C(N2CCC(C)C)S(=O)(=O)C(C)C

InChI

InChI=1S/C18H30N4O3S/c1-13(2)7-8-22-16(10-19-18(22)26(23,24)14(3)4)11-21(6)12-17-9-15(5)20-25-17/h9-10,13-14H,7-8,11-12H2,1-6H3/p+1