(2R)-3-(1H-imidazol-3-ium-5-yl)-2-[(5-methylthiophen-2-yl)sulfonylamino]propanoate

Systemtic Name: (2R)-3-(1H-imidazol-3-ium-5-yl)-2-[(5-methylthiophen-2-yl)sulfonylamino]propanoate Openeye Name: (2R)-3-(1H-imidazol-3-ium-5-yl)-2-[(5-methyl-2-thienyl)sulfonylamino]propanoate CAS Name: (2R)-3-(1H-imidazol-3-ium-5-yl)-2-[(5-methyl-2-thiophenyl)sulfonylamino]propanoate IUPAC Name: (2R)-3-(1H-imidazol-3-ium-5-yl)-2-[(5-methylthiophen-2-yl)sulfonylamino]propanoate Traditional Name: (2R)-3-(1H-imidazol-3-ium-5-yl)-2-[(5-methyl-2-thienyl)sulfonylamino]propionate Formula: C11H13N3O4S2 MolecularWeight: 315.36862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)NC(CC2=C[NH+]=CN2)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N[C@H](CC2=C[NH+]=CN2)C(=O)[O-]

InChI

InChI=1S/C11H13N3O4S2/c1-7-2-3-10(19-7)20(17,18)14-9(11(15)16)4-8-5-12-6-13-8/h2-3,5-6,9,14H,4H2,1H3,(H,12,13)(H,15,16)/t9-/m1/s1