1-(2-bromophenyl)-5-oxidanylidene-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)pyrrolidine-3-carboxamide

Systemtic Name: 1-(2-bromophenyl)-5-oxidanylidene-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)pyrrolidine-3-carboxamide Openeye Name: 1-(2-bromophenyl)-5-oxo-N-(5-thioxo-1H-1,2,4-triazol-4-yl)pyrrolidine-3-carboxamide CAS Name: 1-(2-bromophenyl)-5-oxo-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)-3-pyrrolidinecarboxamide IUPAC Name: 1-(2-bromophenyl)-5-oxo-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)pyrrolidine-3-carboxamide Traditional Name: 1-(2-bromophenyl)-5-keto-N-(5-thioxo-1H-1,2,4-triazol-4-yl)pyrrolidine-3-carboxamide Formula: C13H12BrN5O2S MolecularWeight: 382.23568

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC=CC=C2Br)C(=O)NN3C=NNC3=S

Isomeric SMILES

C1C(CN(C1=O)C2=CC=CC=C2Br)C(=O)NN3C=NNC3=S

InChI

InChI=1S/C13H12BrN5O2S/c14-9-3-1-2-4-10(9)18-6-8(5-11(18)20)12(21)17-19-7-15-16-13(19)22/h1-4,7-8H,5-6H2,(H,16,22)(H,17,21)