N-(4-bromophenyl)-3-(methylsulfanylmethyl)-5-thiophen-2-yl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(4-bromophenyl)-3-(methylsulfanylmethyl)-5-thiophen-2-yl-1,2,3-triazole-4-carboxamide Openeye Name: N-(4-bromophenyl)-3-(methylsulfanylmethyl)-5-(2-thienyl)triazole-4-carboxamide CAS Name: N-(4-bromophenyl)-3-[(methylthio)methyl]-5-thiophen-2-yl-4-triazolecarboxamide IUPAC Name: N-(4-bromophenyl)-3-(methylsulfanylmethyl)-5-thiophen-2-yltriazole-4-carboxamide Traditional Name: N-(4-bromophenyl)-3-[(methylthio)methyl]-5-(2-thienyl)triazole-4-carboxamide Formula: C15H13BrN4OS2 MolecularWeight: 409.32392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCN1C(=C(N=N1)C2=CC=CS2)C(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

CSCN1C(=C(N=N1)C2=CC=CS2)C(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C15H13BrN4OS2/c1-22-9-20-14(13(18-19-20)12-3-2-8-23-12)15(21)17-11-6-4-10(16)5-7-11/h2-8H,9H2,1H3,(H,17,21)