butyl 4-(2,2-dimethylpropanoylcarbamothioylamino)benzoate

Systemtic Name: butyl 4-(2,2-dimethylpropanoylcarbamothioylamino)benzoate Openeye Name: butyl 4-(2,2-dimethylpropanoylcarbamothioylamino)benzoate CAS Name: 4-[[[(2,2-dimethyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-(2,2-dimethylpropanoylcarbamothioylamino)benzoate Traditional Name: 4-(pivaloylthiocarbamoylamino)benzoic acid butyl ester Formula: C17H24N2O3S MolecularWeight: 336.44906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C(C)(C)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C(C)(C)C

InChI

InChI=1S/C17H24N2O3S/c1-5-6-11-22-14(20)12-7-9-13(10-8-12)18-16(23)19-15(21)17(2,3)4/h7-10H,5-6,11H2,1-4H3,(H2,18,19,21,23)