5-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-3-methyl-1,2-oxazole

Systemtic Name: 5-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-3-methyl-1,2-oxazole Openeye Name: 5-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-3-methyl-isoxazole CAS Name: 5-[[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]thio]methyl]-3-methylisoxazole IUPAC Name: 5-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-3-methyl-1,2-oxazole Traditional Name: 5-[[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]thio]methyl]-3-methyl-isoxazole Formula: C14H20N4OS MolecularWeight: 292.3998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CSC2=NNC(=N2)CCC3CCCC3

Isomeric SMILES

CC1=NOC(=C1)CSC2=NNC(=N2)CCC3CCCC3

InChI

InChI=1S/C14H20N4OS/c1-10-8-12(19-18-10)9-20-14-15-13(16-17-14)7-6-11-4-2-3-5-11/h8,11H,2-7,9H2,1H3,(H,15,16,17)