1-(3-bromophenyl)-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(3-bromophenyl)-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-(3-bromophenyl)-N-[3-(2-thioxo-1H-imidazol-3-yl)phenyl]triazole-4-carboxamide CAS Name: 1-(3-bromophenyl)-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]-4-triazolecarboxamide IUPAC Name: 1-(3-bromophenyl)-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]triazole-4-carboxamide Traditional Name: 1-(3-bromophenyl)-N-[3-(2-thioxo-4-imidazolin-1-yl)phenyl]triazole-4-carboxamide Formula: C18H13BrN6OS MolecularWeight: 441.30442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CN(N=N2)C3=CC(=CC=C3)Br)N4C=CNC4=S

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CN(N=N2)C3=CC(=CC=C3)Br)N4C=CNC4=S

InChI

InChI=1S/C18H13BrN6OS/c19-12-3-1-6-15(9-12)25-11-16(22-23-25)17(26)21-13-4-2-5-14(10-13)24-8-7-20-18(24)27/h1-11H,(H,20,27)(H,21,26)