ethyl 4-(ethylcarbamothioylamino)benzoate

Systemtic Name: ethyl 4-(ethylcarbamothioylamino)benzoate Openeye Name: ethyl 4-(ethylcarbamothioylamino)benzoate CAS Name: 4-[[ethylamino(sulfanylidene)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(ethylcarbamothioylamino)benzoate Traditional Name: 4-(ethylthiocarbamoylamino)benzoic acid ethyl ester Formula: C12H16N2O2S MolecularWeight: 252.33264

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NC1=CC=C(C=C1)C(=O)OCC

Isomeric SMILES

CCNC(=S)NC1=CC=C(C=C1)C(=O)OCC

InChI

InChI=1S/C12H16N2O2S/c1-3-13-12(17)14-10-7-5-9(6-8-10)11(15)16-4-2/h5-8H,3-4H2,1-2H3,(H2,13,14,17)