4-phenyl-3-[5-(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)pentyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-phenyl-3-[5-(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)pentyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-phenyl-3-[5-(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)pentyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-phenyl-3-[5-(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)pentyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-phenyl-3-[5-(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)pentyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-phenyl-3-[5-(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)pentyl]-1H-1,2,4-triazole-5-thione Formula: C21H22N6S2 MolecularWeight: 422.56958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NNC2=S)CCCCCC3=NNC(=S)N3C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NNC2=S)CCCCCC3=NNC(=S)N3C4=CC=CC=C4

InChI

InChI=1S/C21H22N6S2/c28-20-24-22-18(26(20)16-10-4-1-5-11-16)14-8-3-9-15-19-23-25-21(29)27(19)17-12-6-2-7-13-17/h1-2,4-7,10-13H,3,8-9,14-15H2,(H,24,28)(H,25,29)