(4R)-1-[(4-methylphenyl)carbamothioyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: (4R)-1-[(4-methylphenyl)carbamothioyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: (4R)-4-hydroxy-1-(p-tolylcarbamothioyl)pyrrolidine-2-carboxylic acid CAS Name: (4R)-4-hydroxy-1-[(4-methylanilino)-sulfanylidenemethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (4R)-4-hydroxy-1-[(4-methylphenyl)carbamothioyl]pyrrolidine-2-carboxylic acid Traditional Name: (4R)-4-hydroxy-1-(p-tolylthiocarbamoyl)proline Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)N2CC(CC2C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)N2C[C@@H](CC2C(=O)O)O

InChI

InChI=1S/C13H16N2O3S/c1-8-2-4-9(5-3-8)14-13(19)15-7-10(16)6-11(15)12(17)18/h2-5,10-11,16H,6-7H2,1H3,(H,14,19)(H,17,18)/t10-,11?/m1/s1