3-[2-(4-methoxyphenyl)ethylsulfanyl]-4-methyl-5-(2-methylfuran-3-yl)-1,2,4-triazole

Systemtic Name: 3-[2-(4-methoxyphenyl)ethylsulfanyl]-4-methyl-5-(2-methylfuran-3-yl)-1,2,4-triazole Openeye Name: 3-[2-(4-methoxyphenyl)ethylsulfanyl]-4-methyl-5-(2-methyl-3-furyl)-1,2,4-triazole CAS Name: 3-[2-(4-methoxyphenyl)ethylthio]-4-methyl-5-(2-methyl-3-furanyl)-1,2,4-triazole IUPAC Name: 3-[2-(4-methoxyphenyl)ethylsulfanyl]-4-methyl-5-(2-methylfuran-3-yl)-1,2,4-triazole Traditional Name: 3-[2-(4-methoxyphenyl)ethylthio]-4-methyl-5-(2-methyl-3-furyl)-1,2,4-triazole Formula: C17H19N3O2S MolecularWeight: 329.41666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C2=NN=C(N2C)SCCC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C=CO1)C2=NN=C(N2C)SCCC3=CC=C(C=C3)OC

InChI

InChI=1S/C17H19N3O2S/c1-12-15(8-10-22-12)16-18-19-17(20(16)2)23-11-9-13-4-6-14(21-3)7-5-13/h4-8,10H,9,11H2,1-3H3