3-(2-methylfuran-3-yl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-(2-methylfuran-3-yl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(2-methyl-3-furyl)-5-(o-tolylmethylsulfanyl)-1,2,4-triazol-4-amine CAS Name: 3-(2-methyl-3-furanyl)-5-[(2-methylphenyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(2-methylfuran-3-yl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-[(2-methylbenzyl)thio]-5-(2-methyl-3-furyl)-1,2,4-triazol-4-yl]amine Formula: C15H16N4OS MolecularWeight: 300.37874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NN=C(N2N)C3=C(OC=C3)C

Isomeric SMILES

CC1=CC=CC=C1CSC2=NN=C(N2N)C3=C(OC=C3)C

InChI

InChI=1S/C15H16N4OS/c1-10-5-3-4-6-12(10)9-21-15-18-17-14(19(15)16)13-7-8-20-11(13)2/h3-8H,9,16H2,1-2H3