ethyl 4-[(4-ethoxyphenyl)carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[(4-ethoxyphenyl)carbamothioylamino]benzoate Openeye Name: ethyl 4-[(4-ethoxyphenyl)carbamothioylamino]benzoate CAS Name: 4-[[(4-ethoxyanilino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-ethoxyphenyl)carbamothioylamino]benzoate Traditional Name: 4-(p-phenetylthiocarbamoylamino)benzoic acid ethyl ester Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C(=O)OCC

InChI

InChI=1S/C18H20N2O3S/c1-3-22-16-11-9-15(10-12-16)20-18(24)19-14-7-5-13(6-8-14)17(21)23-4-2/h5-12H,3-4H2,1-2H3,(H2,19,20,24)