propyl 4-[2-(4-bromanylphenoxy)ethanoylcarbamothioylamino]benzoate

Systemtic Name: propyl 4-[2-(4-bromanylphenoxy)ethanoylcarbamothioylamino]benzoate Openeye Name: propyl 4-[[2-(4-bromophenoxy)acetyl]carbamothioylamino]benzoate CAS Name: 4-[[[[2-(4-bromophenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[2-(4-bromophenoxy)acetyl]carbamothioylamino]benzoate Traditional Name: 4-[[2-(4-bromophenoxy)acetyl]thiocarbamoylamino]benzoic acid propyl ester Formula: C19H19BrN2O4S MolecularWeight: 451.33416

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)COC2=CC=C(C=C2)Br

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)COC2=CC=C(C=C2)Br

InChI

InChI=1S/C19H19BrN2O4S/c1-2-11-25-18(24)13-3-7-15(8-4-13)21-19(27)22-17(23)12-26-16-9-5-14(20)6-10-16/h3-10H,2,11-12H2,1H3,(H2,21,22,23,27)