(2-methyl-2-oxidanyl-propyl) 4-carbamothioylpiperazine-1-carboxylate

Systemtic Name: (2-methyl-2-oxidanyl-propyl) 4-carbamothioylpiperazine-1-carboxylate Openeye Name: (2-hydroxy-2-methyl-propyl) 4-carbamothioylpiperazine-1-carboxylate CAS Name: 4-carbamothioyl-1-piperazinecarboxylic acid (2-hydroxy-2-methylpropyl) ester IUPAC Name: (2-hydroxy-2-methylpropyl) 4-carbamothioylpiperazine-1-carboxylate Traditional Name: 4-thiocarbamoylpiperazine-1-carboxylic acid (2-hydroxy-2-methyl-propyl) ester Formula: C10H19N3O3S MolecularWeight: 261.34116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COC(=O)N1CCN(CC1)C(=S)N)O

Isomeric SMILES

CC(C)(COC(=O)N1CCN(CC1)C(=S)N)O

InChI

InChI=1S/C10H19N3O3S/c1-10(2,15)7-16-9(14)13-5-3-12(4-6-13)8(11)17/h15H,3-7H2,1-2H3,(H2,11,17)