3-(4-methoxyphenyl)-5-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2-oxazole

Systemtic Name: 3-(4-methoxyphenyl)-5-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2-oxazole Openeye Name: 5-[(4-isopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(4-methoxyphenyl)isoxazole CAS Name: 3-(4-methoxyphenyl)-5-[[(4-propan-2-yl-1,2,4-triazol-3-yl)thio]methyl]isoxazole IUPAC Name: 3-(4-methoxyphenyl)-5-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2-oxazole Traditional Name: 5-[[(4-isopropyl-1,2,4-triazol-3-yl)thio]methyl]-3-(4-methoxyphenyl)isoxazole Formula: C16H18N4O2S MolecularWeight: 330.40472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NN=C1SCC2=CC(=NO2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)N1C=NN=C1SCC2=CC(=NO2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C16H18N4O2S/c1-11(2)20-10-17-18-16(20)23-9-14-8-15(19-22-14)12-4-6-13(21-3)7-5-12/h4-8,10-11H,9H2,1-3H3