N-[(2-bromophenyl)carbamothioyl]-4-chloranyl-2-ethyl-pyrazole-3-carboxamide

Systemtic Name: N-[(2-bromophenyl)carbamothioyl]-4-chloranyl-2-ethyl-pyrazole-3-carboxamide Openeye Name: N-[(2-bromophenyl)carbamothioyl]-4-chloro-2-ethyl-pyrazole-3-carboxamide CAS Name: N-[(2-bromoanilino)-sulfanylidenemethyl]-4-chloro-2-ethyl-3-pyrazolecarboxamide IUPAC Name: N-[(2-bromophenyl)carbamothioyl]-4-chloro-2-ethylpyrazole-3-carboxamide Traditional Name: N-[(2-bromophenyl)thiocarbamoyl]-4-chloro-2-ethyl-pyrazole-3-carboxamide Formula: C13H12BrClN4OS MolecularWeight: 387.68258

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)Cl)C(=O)NC(=S)NC2=CC=CC=C2Br

Isomeric SMILES

CCN1C(=C(C=N1)Cl)C(=O)NC(=S)NC2=CC=CC=C2Br

InChI

InChI=1S/C13H12BrClN4OS/c1-2-19-11(9(15)7-16-19)12(20)18-13(21)17-10-6-4-3-5-8(10)14/h3-7H,2H2,1H3,(H2,17,18,20,21)