2-(phenylmethyl)-6-phenylsulfanyl-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(phenylmethyl)-6-phenylsulfanyl-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-benzyl-6-phenylsulfanyl-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(phenylmethyl)-6-(phenylthio)benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-benzyl-6-phenylsulfanylbenzo[de]isoquinoline-1,3-dione Traditional Name: 2-benzyl-6-(phenylthio)benzo[de]isoquinoline-1,3-quinone Formula: C25H17NO2S MolecularWeight: 395.47298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C4C(=C(C=C3)SC5=CC=CC=C5)C=CC=C4C2=O

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C4C(=C(C=C3)SC5=CC=CC=C5)C=CC=C4C2=O

InChI

InChI=1S/C25H17NO2S/c27-24-20-13-7-12-19-22(29-18-10-5-2-6-11-18)15-14-21(23(19)20)25(28)26(24)16-17-8-3-1-4-9-17/h1-15H,16H2