4-[2-[2-(furan-2-ylmethylsulfanyl)ethylamino]-2-oxidanylidene-ethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[2-[2-(furan-2-ylmethylsulfanyl)ethylamino]-2-oxidanylidene-ethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-[2-[2-(2-furylmethylsulfanyl)ethylamino]-2-oxo-ethyl]-5-(2-thienyl)-1,2,4-triazole-3-thiolate CAS Name: 4-[2-[2-(2-furanylmethylthio)ethylamino]-2-oxoethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate IUPAC Name: 4-[2-[2-(furan-2-ylmethylsulfanyl)ethylamino]-2-oxoethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-[2-[2-(2-furfurylthio)ethylamino]-2-keto-ethyl]-5-(2-thienyl)-1,2,4-triazole-3-thiolate Formula: C15H15N4O2S3- MolecularWeight: 379.5002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CSCCNC(=O)CN2C(=NN=C2[S-])C3=CC=CS3

Isomeric SMILES

C1=COC(=C1)CSCCNC(=O)CN2C(=NN=C2[S-])C3=CC=CS3

InChI

InChI=1S/C15H16N4O2S3/c20-13(16-5-8-23-10-11-3-1-6-21-11)9-19-14(17-18-15(19)22)12-4-2-7-24-12/h1-4,6-7H,5,8-10H2,(H,16,20)(H,18,22)/p-1