ethyl 4-[(2-methyl-1-oxidanyl-propan-2-yl)carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[(2-methyl-1-oxidanyl-propan-2-yl)carbamothioylamino]benzoate Openeye Name: ethyl 4-[(2-hydroxy-1,1-dimethyl-ethyl)carbamothioylamino]benzoate CAS Name: 4-[[[(1-hydroxy-2-methylpropan-2-yl)amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(1-hydroxy-2-methylpropan-2-yl)carbamothioylamino]benzoate Traditional Name: 4-[(2-hydroxy-1,1-dimethyl-ethyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C14H20N2O3S MolecularWeight: 296.3852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(C)(C)CO

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(C)(C)CO

InChI

InChI=1S/C14H20N2O3S/c1-4-19-12(18)10-5-7-11(8-6-10)15-13(20)16-14(2,3)9-17/h5-8,17H,4,9H2,1-3H3,(H2,15,16,20)