1-(4-pyrazin-2-ylpiperazin-1-yl)-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanone

Systemtic Name: 1-(4-pyrazin-2-ylpiperazin-1-yl)-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanone Openeye Name: 1-(4-pyrazin-2-ylpiperazin-1-yl)-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]ethanone CAS Name: 1-[4-(2-pyrazinyl)-1-piperazinyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanone IUPAC Name: 1-(4-pyrazin-2-ylpiperazin-1-yl)-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanone Traditional Name: 1-(4-pyrazin-2-ylpiperazino)-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]ethanone Formula: C16H17N7OS2 MolecularWeight: 387.48248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CN=C2)C(=O)CN3C(=NNC3=S)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=NC=CN=C2)C(=O)CN3C(=NNC3=S)C4=CC=CS4

InChI

InChI=1S/C16H17N7OS2/c24-14(11-23-15(19-20-16(23)25)12-2-1-9-26-12)22-7-5-21(6-8-22)13-10-17-3-4-18-13/h1-4,9-10H,5-8,11H2,(H,20,25)