O-(3-oxidanylpyrrolidin-1-yl) N-(2,4-dimethylphenyl)carbamothioate

Systemtic Name: O-(3-oxidanylpyrrolidin-1-yl) N-(2,4-dimethylphenyl)carbamothioate Openeye Name: O-(3-hydroxypyrrolidin-1-yl) N-(2,4-dimethylphenyl)carbamothioate CAS Name: N-(2,4-dimethylphenyl)carbamothioic acid O-[(3-hydroxy-1-pyrrolidinyl)] ester IUPAC Name: O-(3-hydroxypyrrolidin-1-yl) N-(2,4-dimethylphenyl)carbamothioate Traditional Name: N-(2,4-dimethylphenyl)thiocarbamic acid O-(3-hydroxypyrrolidino) ester Formula: C13H18N2O2S MolecularWeight: 266.35922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)ON2CCC(C2)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)ON2CCC(C2)O)C

InChI

InChI=1S/C13H18N2O2S/c1-9-3-4-12(10(2)7-9)14-13(18)17-15-6-5-11(16)8-15/h3-4,7,11,16H,5-6,8H2,1-2H3,(H,14,18)