3-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-thiophen-2-yl-1,2-oxazole

Systemtic Name: 3-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-thiophen-2-yl-1,2-oxazole Openeye Name: 3-[[4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-(2-thienyl)isoxazole CAS Name: 3-[[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]methyl]-5-thiophen-2-ylisoxazole IUPAC Name: 3-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-thiophen-2-yl-1,2-oxazole Traditional Name: 3-[[[4-(o-tolyl)-1,2,4-triazol-3-yl]thio]methyl]-5-(2-thienyl)isoxazole Formula: C17H14N4OS2 MolecularWeight: 354.44926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=NN=C2SCC3=NOC(=C3)C4=CC=CS4

Isomeric SMILES

CC1=CC=CC=C1N2C=NN=C2SCC3=NOC(=C3)C4=CC=CS4

InChI

InChI=1S/C17H14N4OS2/c1-12-5-2-3-6-14(12)21-11-18-19-17(21)24-10-13-9-15(22-20-13)16-7-4-8-23-16/h2-9,11H,10H2,1H3