ethyl 4-(propanoylcarbamothioylamino)benzoate

Systemtic Name: ethyl 4-(propanoylcarbamothioylamino)benzoate Openeye Name: ethyl 4-(propanoylcarbamothioylamino)benzoate CAS Name: 4-[[(1-oxopropylamino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(propanoylcarbamothioylamino)benzoate Traditional Name: 4-(propionylthiocarbamoylamino)benzoic acid ethyl ester Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(=S)NC1=CC=C(C=C1)C(=O)OCC

Isomeric SMILES

CCC(=O)NC(=S)NC1=CC=C(C=C1)C(=O)OCC

InChI

InChI=1S/C13H16N2O3S/c1-3-11(16)15-13(19)14-10-7-5-9(6-8-10)12(17)18-4-2/h5-8H,3-4H2,1-2H3,(H2,14,15,16,19)