3-[(2-bromophenyl)methylsulfanyl]-5-thiophen-2-yl-1H-1,2,4-triazole

Systemtic Name: 3-[(2-bromophenyl)methylsulfanyl]-5-thiophen-2-yl-1H-1,2,4-triazole Openeye Name: 3-[(2-bromophenyl)methylsulfanyl]-5-(2-thienyl)-1H-1,2,4-triazole CAS Name: 3-[(2-bromophenyl)methylthio]-5-thiophen-2-yl-1H-1,2,4-triazole IUPAC Name: 3-[(2-bromophenyl)methylsulfanyl]-5-thiophen-2-yl-1H-1,2,4-triazole Traditional Name: 3-[(2-bromobenzyl)thio]-5-(2-thienyl)-1H-1,2,4-triazole Formula: C13H10BrN3S2 MolecularWeight: 352.2726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NNC(=N2)C3=CC=CS3)Br

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NNC(=N2)C3=CC=CS3)Br

InChI

InChI=1S/C13H10BrN3S2/c14-10-5-2-1-4-9(10)8-19-13-15-12(16-17-13)11-6-3-7-18-11/h1-7H,8H2,(H,15,16,17)