1-[2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]-N-methyl-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]methanamine

Systemtic Name: 1-[2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]-N-methyl-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]methanamine Openeye Name: 1-[2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]-N-methyl-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]methanamine CAS Name: 1-[2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)-4-imidazolyl]-N-methyl-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]methanamine IUPAC Name: 1-[2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]-N-methyl-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]methanamine Traditional Name: [2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl-methyl-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]amine Formula: C17H28N5O3S+ MolecularWeight: 382.50092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[NH+]=C(N1)CN(C)CC2=CN=C(N2CCOC)S(=O)(=O)CC3CC3

Isomeric SMILES

CC1=C[NH+]=C(N1)CN(C)CC2=CN=C(N2CCOC)S(=O)(=O)CC3CC3

InChI

InChI=1S/C17H27N5O3S/c1-13-8-18-16(20-13)11-21(2)10-15-9-19-17(22(15)6-7-25-3)26(23,24)12-14-4-5-14/h8-9,14H,4-7,10-12H2,1-3H3,(H,18,20)/p+1