ethyl 4-[(2-ethanoylphenyl)carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[(2-ethanoylphenyl)carbamothioylamino]benzoate Openeye Name: ethyl 4-[(2-acetylphenyl)carbamothioylamino]benzoate CAS Name: 4-[[(2-acetylanilino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-acetylphenyl)carbamothioylamino]benzoate Traditional Name: 4-[(2-acetylphenyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2C(=O)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2C(=O)C

InChI

InChI=1S/C18H18N2O3S/c1-3-23-17(22)13-8-10-14(11-9-13)19-18(24)20-16-7-5-4-6-15(16)12(2)21/h4-11H,3H2,1-2H3,(H2,19,20,24)