[(2R,4S)-2,4-dimethyl-1-oxidanidyl-3-oxidanyl-5-thiophen-2-yl-4H-imidazol-1-ium-2-yl]-(4-methoxyphenyl)methanone

Systemtic Name: [(2R,4S)-2,4-dimethyl-1-oxidanidyl-3-oxidanyl-5-thiophen-2-yl-4H-imidazol-1-ium-2-yl]-(4-methoxyphenyl)methanone Openeye Name: [(2R,4S)-3-hydroxy-2,4-dimethyl-1-oxido-5-(2-thienyl)-4H-imidazol-1-ium-2-yl]-(4-methoxyphenyl)methanone CAS Name: [(2R,4S)-3-hydroxy-2,4-dimethyl-1-oxido-5-thiophen-2-yl-4H-imidazol-1-ium-2-yl]-(4-methoxyphenyl)methanone IUPAC Name: [(2R,4S)-3-hydroxy-2,4-dimethyl-1-oxido-5-thiophen-2-yl-4H-imidazol-1-ium-2-yl]-(4-methoxyphenyl)methanone Traditional Name: [(2R,5S)-1-hydroxy-2,5-dimethyl-3-oxido-4-(2-thienyl)-3-imidazolin-3-ium-2-yl]-(4-methoxyphenyl)methanone Formula: C17H18N2O4S MolecularWeight: 346.40082

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=[N+](C(N1O)(C)C(=O)C2=CC=C(C=C2)OC)[O-])C3=CC=CS3

Isomeric SMILES

C[C@H]1C(=[N+]([C@](N1O)(C)C(=O)C2=CC=C(C=C2)OC)[O-])C3=CC=CS3

InChI

InChI=1S/C17H18N2O4S/c1-11-15(14-5-4-10-24-14)19(22)17(2,18(11)21)16(20)12-6-8-13(23-3)9-7-12/h4-11,21H,1-3H3/t11-,17+/m0/s1