[2-(cyclopropylmethylsulfonyl)-3-[[(2R)-oxolan-2-yl]methyl]imidazol-4-yl]methyl-prop-2-enyl-prop-2-ynyl-azanium

Systemtic Name: [2-(cyclopropylmethylsulfonyl)-3-[[(2R)-oxolan-2-yl]methyl]imidazol-4-yl]methyl-prop-2-enyl-prop-2-ynyl-azanium Openeye Name: allyl-[[2-(cyclopropylmethylsulfonyl)-3-[[(2R)-tetrahydrofuran-2-yl]methyl]imidazol-4-yl]methyl]-prop-2-ynyl-ammonium CAS Name: [2-(cyclopropylmethylsulfonyl)-3-[[(2R)-2-oxolanyl]methyl]-4-imidazolyl]methyl-prop-2-enyl-prop-2-ynylammonium IUPAC Name: [2-(cyclopropylmethylsulfonyl)-3-[[(2R)-oxolan-2-yl]methyl]imidazol-4-yl]methyl-prop-2-enyl-prop-2-ynylazanium Traditional Name: allyl-[[2-(cyclopropylmethylsulfonyl)-3-[[(2R)-tetrahydrofuran-2-yl]methyl]imidazol-4-yl]methyl]-propargyl-ammonium Formula: C19H28N3O3S+ MolecularWeight: 378.50892

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+](CC#C)CC1=CN=C(N1CC2CCCO2)S(=O)(=O)CC3CC3

Isomeric SMILES

C=CC[NH+](CC#C)CC1=CN=C(N1C[C@H]2CCCO2)S(=O)(=O)CC3CC3

InChI

InChI=1S/C19H27N3O3S/c1-3-9-21(10-4-2)13-17-12-20-19(26(23,24)15-16-7-8-16)22(17)14-18-6-5-11-25-18/h1,4,12,16,18H,2,5-11,13-15H2/p+1/t18-/m1/s1