butyl 3-(2-phenoxyethanoylcarbamothioylamino)benzoate

Systemtic Name: butyl 3-(2-phenoxyethanoylcarbamothioylamino)benzoate Openeye Name: butyl 3-[(2-phenoxyacetyl)carbamothioylamino]benzoate CAS Name: 3-[[[(1-oxo-2-phenoxyethyl)amino]-sulfanylidenemethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 3-[(2-phenoxyacetyl)carbamothioylamino]benzoate Traditional Name: 3-[(2-phenoxyacetyl)thiocarbamoylamino]benzoic acid butyl ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CCCCOC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C20H22N2O4S/c1-2-3-12-25-19(24)15-8-7-9-16(13-15)21-20(27)22-18(23)14-26-17-10-5-4-6-11-17/h4-11,13H,2-3,12,14H2,1H3,(H2,21,22,23,27)