ethyl 4-[(4-phenethyloxyphenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: ethyl 4-[(4-phenethyloxyphenyl)carbonylcarbamothioylamino]benzoate Openeye Name: ethyl 4-[(4-phenethyloxybenzoyl)carbamothioylamino]benzoate CAS Name: 4-[[[[oxo-(4-phenethyloxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-phenethyloxybenzoyl)carbamothioylamino]benzoate Traditional Name: 4-[(4-phenethyloxybenzoyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C25H24N2O4S MolecularWeight: 448.53406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCCC3=CC=CC=C3

InChI

InChI=1S/C25H24N2O4S/c1-2-30-24(29)20-8-12-21(13-9-20)26-25(32)27-23(28)19-10-14-22(15-11-19)31-17-16-18-6-4-3-5-7-18/h3-15H,2,16-17H2,1H3,(H2,26,27,28,32)