ethyl 4-(phenethylcarbamothioylamino)benzoate

Systemtic Name: ethyl 4-(phenethylcarbamothioylamino)benzoate Openeye Name: ethyl 4-(phenethylcarbamothioylamino)benzoate CAS Name: 4-[[(phenethylamino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(phenethylcarbamothioylamino)benzoate Traditional Name: 4-(phenethylthiocarbamoylamino)benzoic acid ethyl ester Formula: C18H20N2O2S MolecularWeight: 328.4286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NCCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NCCC2=CC=CC=C2

InChI

InChI=1S/C18H20N2O2S/c1-2-22-17(21)15-8-10-16(11-9-15)20-18(23)19-13-12-14-6-4-3-5-7-14/h3-11H,2,12-13H2,1H3,(H2,19,20,23)