methyl (2R)-4-[(5-phenyl-2-sulfanylidene-1,3,4-oxadiazol-3-yl)methyl]thiomorpholin-4-ium-2-carboxylate

Systemtic Name: methyl (2R)-4-[(5-phenyl-2-sulfanylidene-1,3,4-oxadiazol-3-yl)methyl]thiomorpholin-4-ium-2-carboxylate Openeye Name: methyl (2R)-4-[(5-phenyl-2-thioxo-1,3,4-oxadiazol-3-yl)methyl]thiomorpholin-4-ium-2-carboxylate CAS Name: (2R)-4-[(5-phenyl-2-sulfanylidene-1,3,4-oxadiazol-3-yl)methyl]-2-thiomorpholin-4-iumcarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-[(5-phenyl-2-sulfanylidene-1,3,4-oxadiazol-3-yl)methyl]thiomorpholin-4-ium-2-carboxylate Traditional Name: (2R)-4-[(5-phenyl-2-thioxo-1,3,4-oxadiazol-3-yl)methyl]thiomorpholin-4-ium-2-carboxylic acid methyl ester Formula: C15H18N3O3S2+ MolecularWeight: 352.45172

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C[NH+](CCS1)CN2C(=S)OC(=N2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)[C@H]1C[NH+](CCS1)CN2C(=S)OC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C15H17N3O3S2/c1-20-14(19)12-9-17(7-8-23-12)10-18-15(22)21-13(16-18)11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3/p+1/t12-/m1/s1