ethyl 4-[(4-bromophenyl)carbonylcarbamothioyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(4-bromophenyl)carbonylcarbamothioyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(4-bromobenzoyl)carbamothioyl]piperazine-1-carboxylate CAS Name: 4-[[[(4-bromophenyl)-oxomethyl]amino]-sulfanylidenemethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-bromobenzoyl)carbamothioyl]piperazine-1-carboxylate Traditional Name: 4-[(4-bromobenzoyl)thiocarbamoyl]piperazine-1-carboxylic acid ethyl ester Formula: C15H18BrN3O3S MolecularWeight: 400.29072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=S)NC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=S)NC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C15H18BrN3O3S/c1-2-22-15(21)19-9-7-18(8-10-19)14(23)17-13(20)11-3-5-12(16)6-4-11/h3-6H,2,7-10H2,1H3,(H,17,20,23)