5-(1,3-benzothiazol-2-yl)-2-(2-phenylphenyl)isoindole-1,3-dione

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-2-(2-phenylphenyl)isoindole-1,3-dione Openeye Name: 5-(1,3-benzothiazol-2-yl)-2-(2-phenylphenyl)isoindoline-1,3-dione CAS Name: 5-(1,3-benzothiazol-2-yl)-2-(2-phenylphenyl)isoindole-1,3-dione IUPAC Name: 5-(1,3-benzothiazol-2-yl)-2-(2-phenylphenyl)isoindole-1,3-dione Traditional Name: 5-(1,3-benzothiazol-2-yl)-2-(2-phenylphenyl)isoindoline-1,3-quinone Formula: C27H16N2O2S MolecularWeight: 432.49314

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CC=C2N3C(=O)C4=C(C3=O)C=C(C=C4)C5=NC6=CC=CC=C6S5

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2N3C(=O)C4=C(C3=O)C=C(C=C4)C5=NC6=CC=CC=C6S5

InChI

InChI=1S/C27H16N2O2S/c30-26-20-15-14-18(25-28-22-11-5-7-13-24(22)32-25)16-21(20)27(31)29(26)23-12-6-4-10-19(23)17-8-2-1-3-9-17/h1-16H