1-(3-bromophenyl)-N-(3-phenylsulfanylpropyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(3-bromophenyl)-N-(3-phenylsulfanylpropyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-(3-bromophenyl)-N-(3-phenylsulfanylpropyl)triazole-4-carboxamide CAS Name: 1-(3-bromophenyl)-N-[3-(phenylthio)propyl]-4-triazolecarboxamide IUPAC Name: 1-(3-bromophenyl)-N-(3-phenylsulfanylpropyl)triazole-4-carboxamide Traditional Name: 1-(3-bromophenyl)-N-[3-(phenylthio)propyl]triazole-4-carboxamide Formula: C18H17BrN4OS MolecularWeight: 417.32278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCNC(=O)C2=CN(N=N2)C3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)SCCCNC(=O)C2=CN(N=N2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C18H17BrN4OS/c19-14-6-4-7-15(12-14)23-13-17(21-22-23)18(24)20-10-5-11-25-16-8-2-1-3-9-16/h1-4,6-9,12-13H,5,10-11H2,(H,20,24)