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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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