3-(2,2-dimethylpropanoylcarbamothioylamino)-4-methyl-benzoate

Systemtic Name: 3-(2,2-dimethylpropanoylcarbamothioylamino)-4-methyl-benzoate Openeye Name: 3-(2,2-dimethylpropanoylcarbamothioylamino)-4-methyl-benzoate CAS Name: 3-[[[(2,2-dimethyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]-4-methylbenzoate IUPAC Name: 3-(2,2-dimethylpropanoylcarbamothioylamino)-4-methylbenzoate Traditional Name: 4-methyl-3-(pivaloylthiocarbamoylamino)benzoate Formula: C14H17N2O3S- MolecularWeight: 293.36138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])NC(=S)NC(=O)C(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])NC(=S)NC(=O)C(C)(C)C

InChI

InChI=1S/C14H18N2O3S/c1-8-5-6-9(11(17)18)7-10(8)15-13(20)16-12(19)14(2,3)4/h5-7H,1-4H3,(H,17,18)(H2,15,16,19,20)/p-1