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

Systemtic Name: 3-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-phenyl-1,2-oxazole Openeye Name: 3-[[5-(4-chlorophenyl)-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-phenyl-isoxazole CAS Name: 3-[[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]methyl]-5-phenylisoxazole IUPAC Name: 3-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-phenyl-1,2-oxazole Traditional Name: 3-[[[5-(4-chlorophenyl)-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]methyl]-5-phenyl-isoxazole Formula: C25H19ClN4OS MolecularWeight: 458.96256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H19ClN4OS/c1-17-7-13-22(14-8-17)30-24(19-9-11-20(26)12-10-19)27-28-25(30)32-16-21-15-23(31-29-21)18-5-3-2-4-6-18/h2-15H,16H2,1H3