1-[(2,4,6-trimethylphenyl)carbamothioyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2,4,6-trimethylphenyl)carbamothioyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2,4,6-trimethylphenyl)carbamothioyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[sulfanylidene-(2,4,6-trimethylanilino)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2,4,6-trimethylphenyl)carbamothioyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-(mesitylthiocarbamoyl)proline Formula: C15H20N2O2S MolecularWeight: 292.3965

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=S)N2CCCC2C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=S)N2CCCC2C(=O)O)C

InChI

InChI=1S/C15H20N2O2S/c1-9-7-10(2)13(11(3)8-9)16-15(20)17-6-4-5-12(17)14(18)19/h7-8,12H,4-6H2,1-3H3,(H,16,20)(H,18,19)