4-methyl-3-(2-methylfuran-3-yl)-5-(phenylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 4-methyl-3-(2-methylfuran-3-yl)-5-(phenylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-4-methyl-5-(2-methyl-3-furyl)-1,2,4-triazole CAS Name: 4-methyl-3-(2-methyl-3-furanyl)-5-(phenylmethylthio)-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-4-methyl-5-(2-methylfuran-3-yl)-1,2,4-triazole Traditional Name: 3-(benzylthio)-4-methyl-5-(2-methyl-3-furyl)-1,2,4-triazole Formula: C15H15N3OS MolecularWeight: 285.3641

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C2=NN=C(N2C)SCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CO1)C2=NN=C(N2C)SCC3=CC=CC=C3

InChI

InChI=1S/C15H15N3OS/c1-11-13(8-9-19-11)14-16-17-15(18(14)2)20-10-12-6-4-3-5-7-12/h3-9H,10H2,1-2H3