(2S,4R)-4-oxidanyl-1-(phenylcarbamothioyl)pyrrolidine-2-carboxylate

Systemtic Name: (2S,4R)-4-oxidanyl-1-(phenylcarbamothioyl)pyrrolidine-2-carboxylate Openeye Name: (2S,4R)-4-hydroxy-1-(phenylcarbamothioyl)pyrrolidine-2-carboxylate CAS Name: (2S,4R)-1-[anilino(sulfanylidene)methyl]-4-hydroxy-2-pyrrolidinecarboxylate IUPAC Name: (2S,4R)-4-hydroxy-1-(phenylcarbamothioyl)pyrrolidine-2-carboxylate Traditional Name: (2S,4R)-4-hydroxy-1-(phenylthiocarbamoyl)pyrrolidine-2-carboxylate Formula: C12H13N2O3S- MolecularWeight: 265.30822

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)[O-])C(=S)NC2=CC=CC=C2)O

Isomeric SMILES

C1[C@H](CN([C@@H]1C(=O)[O-])C(=S)NC2=CC=CC=C2)O

InChI

InChI=1S/C12H14N2O3S/c15-9-6-10(11(16)17)14(7-9)12(18)13-8-4-2-1-3-5-8/h1-5,9-10,15H,6-7H2,(H,13,18)(H,16,17)/p-1/t9-,10+/m1/s1