1-thiophen-2-yl-4-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]butan-1-one

Systemtic Name: 1-thiophen-2-yl-4-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]butan-1-one Openeye Name: 1-(2-thienyl)-4-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]butan-1-one CAS Name: 1-thiophen-2-yl-4-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]-1-butanone IUPAC Name: 1-thiophen-2-yl-4-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]butan-1-one Traditional Name: 1-(2-thienyl)-4-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]butan-1-one Formula: C14H13N3OS3 MolecularWeight: 335.46752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=NN2)SCCCC(=O)C3=CC=CS3

Isomeric SMILES

C1=CSC(=C1)C2=NC(=NN2)SCCCC(=O)C3=CC=CS3

InChI

InChI=1S/C14H13N3OS3/c18-10(11-5-2-7-19-11)4-1-9-21-14-15-13(16-17-14)12-6-3-8-20-12/h2-3,5-8H,1,4,9H2,(H,15,16,17)