3-(4-methylphenyl)-5-[[3-(4-methylphenyl)-2,1-benzoxazol-5-yl]sulfanyl]-2,1-benzoxazole

Systemtic Name: 3-(4-methylphenyl)-5-[[3-(4-methylphenyl)-2,1-benzoxazol-5-yl]sulfanyl]-2,1-benzoxazole Openeye Name: 3-(p-tolyl)-5-[[3-(p-tolyl)-2,1-benzoxazol-5-yl]sulfanyl]-2,1-benzoxazole CAS Name: 3-(4-methylphenyl)-5-[[3-(4-methylphenyl)-2,1-benzoxazol-5-yl]thio]-2,1-benzoxazole IUPAC Name: 3-(4-methylphenyl)-5-[[3-(4-methylphenyl)-2,1-benzoxazol-5-yl]sulfanyl]-2,1-benzoxazole Traditional Name: 3-(p-tolyl)-5-[[3-(p-tolyl)anthranil-5-yl]thio]anthranil Formula: C28H20N2O2S MolecularWeight: 448.5356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)SC4=CC5=C(ON=C5C=C4)C6=CC=C(C=C6)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)SC4=CC5=C(ON=C5C=C4)C6=CC=C(C=C6)C

InChI

InChI=1S/C28H20N2O2S/c1-17-3-7-19(8-4-17)27-23-15-21(11-13-25(23)29-31-27)33-22-12-14-26-24(16-22)28(32-30-26)20-9-5-18(2)6-10-20/h3-16H,1-2H3