ethyl 4-[(4-bromophenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: ethyl 4-[(4-bromophenyl)carbonylcarbamothioylamino]benzoate Openeye Name: ethyl 4-[(4-bromobenzoyl)carbamothioylamino]benzoate CAS Name: 4-[[[[(4-bromophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-bromobenzoyl)carbamothioylamino]benzoate Traditional Name: 4-[(4-bromobenzoyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C17H15BrN2O3S MolecularWeight: 407.2816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H15BrN2O3S/c1-2-23-16(22)12-5-9-14(10-6-12)19-17(24)20-15(21)11-3-7-13(18)8-4-11/h3-10H,2H2,1H3,(H2,19,20,21,24)