methyl 4-(tert-butylcarbamothioylamino)benzoate

Systemtic Name: methyl 4-(tert-butylcarbamothioylamino)benzoate Openeye Name: methyl 4-(tert-butylcarbamothioylamino)benzoate CAS Name: 4-[[(tert-butylamino)-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(tert-butylcarbamothioylamino)benzoate Traditional Name: 4-(tert-butylthiocarbamoylamino)benzoic acid methyl ester Formula: C13H18N2O2S MolecularWeight: 266.35922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NC1=CC=C(C=C1)C(=O)OC

Isomeric SMILES

CC(C)(C)NC(=S)NC1=CC=C(C=C1)C(=O)OC

InChI

InChI=1S/C13H18N2O2S/c1-13(2,3)15-12(18)14-10-7-5-9(6-8-10)11(16)17-4/h5-8H,1-4H3,(H2,14,15,18)