propyl 4-(3,3-dimethylbutanoylcarbamothioylamino)benzoate

Systemtic Name: propyl 4-(3,3-dimethylbutanoylcarbamothioylamino)benzoate Openeye Name: propyl 4-(3,3-dimethylbutanoylcarbamothioylamino)benzoate CAS Name: 4-[[[(3,3-dimethyl-1-oxobutyl)amino]-sulfanylidenemethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-(3,3-dimethylbutanoylcarbamothioylamino)benzoate Traditional Name: 4-(3,3-dimethylbutanoylthiocarbamoylamino)benzoic acid propyl ester Formula: C17H24N2O3S MolecularWeight: 336.44906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N2O3S/c1-5-10-22-15(21)12-6-8-13(9-7-12)18-16(23)19-14(20)11-17(2,3)4/h6-9H,5,10-11H2,1-4H3,(H2,18,19,20,23)