methyl 4-[[4-(2-phenoxyethoxy)phenyl]carbonylcarbamothioylamino]benzoate

Systemtic Name: methyl 4-[[4-(2-phenoxyethoxy)phenyl]carbonylcarbamothioylamino]benzoate Openeye Name: methyl 4-[[4-(2-phenoxyethoxy)benzoyl]carbamothioylamino]benzoate CAS Name: 4-[[[[oxo-[4-(2-phenoxyethoxy)phenyl]methyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(2-phenoxyethoxy)benzoyl]carbamothioylamino]benzoate Traditional Name: 4-[[4-(2-phenoxyethoxy)benzoyl]thiocarbamoylamino]benzoic acid methyl ester Formula: C24H22N2O5S MolecularWeight: 450.50688

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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)OCCOC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCCOC3=CC=CC=C3

InChI

InChI=1S/C24H22N2O5S/c1-29-23(28)18-7-11-19(12-8-18)25-24(32)26-22(27)17-9-13-21(14-10-17)31-16-15-30-20-5-3-2-4-6-20/h2-14H,15-16H2,1H3,(H2,25,26,27,32)