ethyl 3-(2,2-dimethylpropylcarbamothioylamino)benzoate

Systemtic Name: ethyl 3-(2,2-dimethylpropylcarbamothioylamino)benzoate Openeye Name: ethyl 3-(2,2-dimethylpropylcarbamothioylamino)benzoate CAS Name: 3-[[(2,2-dimethylpropylamino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-(2,2-dimethylpropylcarbamothioylamino)benzoate Traditional Name: 3-(neopentylthiocarbamoylamino)benzoic acid ethyl ester Formula: C15H22N2O2S MolecularWeight: 294.41238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O2S/c1-5-19-13(18)11-7-6-8-12(9-11)17-14(20)16-10-15(2,3)4/h6-9H,5,10H2,1-4H3,(H2,16,17,20)