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

Systemtic Name: 2-[[4,5-bis(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-phenyl-1,3-oxazole Openeye Name: 2-[[4,5-bis(p-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-phenyl-oxazole CAS Name: 2-[[[4,5-bis(4-methylphenyl)-1,2,4-triazol-3-yl]thio]methyl]-5-phenyloxazole IUPAC Name: 2-[[4,5-bis(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-phenyl-1,3-oxazole Traditional Name: 2-[[[4,5-bis(p-tolyl)-1,2,4-triazol-3-yl]thio]methyl]-5-phenyl-oxazole Formula: C26H22N4OS MolecularWeight: 438.54408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)C)SCC4=NC=C(O4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)C)SCC4=NC=C(O4)C5=CC=CC=C5

InChI

InChI=1S/C26H22N4OS/c1-18-8-12-21(13-9-18)25-28-29-26(30(25)22-14-10-19(2)11-15-22)32-17-24-27-16-23(31-24)20-6-4-3-5-7-20/h3-16H,17H2,1-2H3