methyl 4-[(2-phenethyloxyphenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: methyl 4-[(2-phenethyloxyphenyl)carbonylcarbamothioylamino]benzoate Openeye Name: methyl 4-[(2-phenethyloxybenzoyl)carbamothioylamino]benzoate CAS Name: 4-[[[[oxo-(2-phenethyloxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-phenethyloxybenzoyl)carbamothioylamino]benzoate Traditional Name: 4-[(2-phenethyloxybenzoyl)thiocarbamoylamino]benzoic acid methyl ester Formula: C24H22N2O4S MolecularWeight: 434.50748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2OCCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2OCCC3=CC=CC=C3

InChI

InChI=1S/C24H22N2O4S/c1-29-23(28)18-11-13-19(14-12-18)25-24(31)26-22(27)20-9-5-6-10-21(20)30-16-15-17-7-3-2-4-8-17/h2-14H,15-16H2,1H3,(H2,25,26,27,31)