[3-(3-methoxypropyl)-2-methylsulfonyl-imidazol-4-yl]methyl-[(1-methylpyrazol-4-yl)methyl]-propan-2-yl-azanium

Systemtic Name: [3-(3-methoxypropyl)-2-methylsulfonyl-imidazol-4-yl]methyl-[(1-methylpyrazol-4-yl)methyl]-propan-2-yl-azanium Openeye Name: isopropyl-[[3-(3-methoxypropyl)-2-methylsulfonyl-imidazol-4-yl]methyl]-[(1-methylpyrazol-4-yl)methyl]ammonium CAS Name: [3-(3-methoxypropyl)-2-methylsulfonyl-4-imidazolyl]methyl-[(1-methyl-4-pyrazolyl)methyl]-propan-2-ylammonium IUPAC Name: [3-(3-methoxypropyl)-2-methylsulfonylimidazol-4-yl]methyl-[(1-methylpyrazol-4-yl)methyl]-propan-2-ylazanium Traditional Name: isopropyl-[[2-mesyl-3-(3-methoxypropyl)imidazol-4-yl]methyl]-[(1-methylpyrazol-4-yl)methyl]ammonium Formula: C17H30N5O3S+ MolecularWeight: 384.5168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CC1=CN=C(N1CCCOC)S(=O)(=O)C)CC2=CN(N=C2)C

Isomeric SMILES

CC(C)[NH+](CC1=CN=C(N1CCCOC)S(=O)(=O)C)CC2=CN(N=C2)C

InChI

InChI=1S/C17H29N5O3S/c1-14(2)21(12-15-9-19-20(3)11-15)13-16-10-18-17(26(5,23)24)22(16)7-6-8-25-4/h9-11,14H,6-8,12-13H2,1-5H3/p+1