2-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]isoindole-1,3-dione

Systemtic Name: 2-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]isoindole-1,3-dione Openeye Name: 2-[[5-(p-tolyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]isoindoline-1,3-dione CAS Name: 2-[[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]thio]methyl]isoindole-1,3-dione IUPAC Name: 2-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]isoindole-1,3-dione Traditional Name: 2-[[[5-(p-tolyl)-1,3,4-oxadiazol-2-yl]thio]methyl]isoindoline-1,3-quinone Formula: C18H13N3O3S MolecularWeight: 351.37912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(O2)SCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(O2)SCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C18H13N3O3S/c1-11-6-8-12(9-7-11)15-19-20-18(24-15)25-10-21-16(22)13-4-2-3-5-14(13)17(21)23/h2-9H,10H2,1H3