2-[3-[(2-cyanophenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-yl]ethanamide

Systemtic Name: 2-[3-[(2-cyanophenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-yl]ethanamide Openeye Name: 2-[3-[(2-cyanophenyl)methylsulfanyl]-5-(2-thienyl)-1,2,4-triazol-4-yl]acetamide CAS Name: 2-[3-[(2-cyanophenyl)methylthio]-5-thiophen-2-yl-1,2,4-triazol-4-yl]acetamide IUPAC Name: 2-[3-[(2-cyanophenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-yl]acetamide Traditional Name: 2-[3-[(2-cyanobenzyl)thio]-5-(2-thienyl)-1,2,4-triazol-4-yl]acetamide Formula: C16H13N5OS2 MolecularWeight: 355.43732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NN=C(N2CC(=O)N)C3=CC=CS3)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NN=C(N2CC(=O)N)C3=CC=CS3)C#N

InChI

InChI=1S/C16H13N5OS2/c17-8-11-4-1-2-5-12(11)10-24-16-20-19-15(13-6-3-7-23-13)21(16)9-14(18)22/h1-7H,9-10H2,(H2,18,22)