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

Systemtic Name: 3-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-(furan-2-yl)-1,2-oxazole Openeye Name: 3-[[5-(4-chlorophenyl)-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-(2-furyl)isoxazole CAS Name: 3-[[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]methyl]-5-(2-furanyl)isoxazole IUPAC Name: 3-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-(furan-2-yl)-1,2-oxazole Traditional Name: 3-[[[5-(4-chlorophenyl)-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]methyl]-5-(2-furyl)isoxazole Formula: C23H17ClN4O2S MolecularWeight: 448.92468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=NOC(=C3)C4=CC=CO4)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=NOC(=C3)C4=CC=CO4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C23H17ClN4O2S/c1-15-4-10-19(11-5-15)28-22(16-6-8-17(24)9-7-16)25-26-23(28)31-14-18-13-21(30-27-18)20-3-2-12-29-20/h2-13H,14H2,1H3