5-[2-(5-methylfuran-2-yl)ethenyl]-3-(2-methylprop-2-enylsulfanyl)-1H-1,2,4-triazole

Systemtic Name: 5-[2-(5-methylfuran-2-yl)ethenyl]-3-(2-methylprop-2-enylsulfanyl)-1H-1,2,4-triazole Openeye Name: 3-(2-methylallylsulfanyl)-5-[2-(5-methyl-2-furyl)vinyl]-1H-1,2,4-triazole CAS Name: 5-[2-(5-methyl-2-furanyl)ethenyl]-3-(2-methylprop-2-enylthio)-1H-1,2,4-triazole IUPAC Name: 5-[2-(5-methylfuran-2-yl)ethenyl]-3-(2-methylprop-2-enylsulfanyl)-1H-1,2,4-triazole Traditional Name: 3-(2-methylallylthio)-5-[2-(5-methyl-2-furyl)vinyl]-1H-1,2,4-triazole Formula: C13H15N3OS MolecularWeight: 261.3427

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C=CC2=NC(=NN2)SCC(=C)C

Isomeric SMILES

CC1=CC=C(O1)C=CC2=NC(=NN2)SCC(=C)C

InChI

InChI=1S/C13H15N3OS/c1-9(2)8-18-13-14-12(15-16-13)7-6-11-5-4-10(3)17-11/h4-7H,1,8H2,2-3H3,(H,14,15,16)