methyl 2-[(3-phenethyloxyphenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: methyl 2-[(3-phenethyloxyphenyl)carbonylcarbamothioylamino]benzoate Openeye Name: methyl 2-[(3-phenethyloxybenzoyl)carbamothioylamino]benzoate CAS Name: 2-[[[[oxo-(3-phenethyloxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(3-phenethyloxybenzoyl)carbamothioylamino]benzoate Traditional Name: 2-[(3-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=CC=C1NC(=S)NC(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=S)NC(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3

InChI

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