N-(4-bromophenyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(4-bromophenyl)-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(4-bromophenyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(4-bromophenyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(4-bromophenyl)-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C14H11BrN4OS2 MolecularWeight: 395.29734

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=NN2)SCC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CSC(=C1)C2=NC(=NN2)SCC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C14H11BrN4OS2/c15-9-3-5-10(6-4-9)16-12(20)8-22-14-17-13(18-19-14)11-2-1-7-21-11/h1-7H,8H2,(H,16,20)(H,17,18,19)