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

Systemtic Name: 6-phenylsulfanyl-2-(2-pyridin-3-ylethyl)benzo[de]isoquinoline-1,3-dione Openeye Name: 6-phenylsulfanyl-2-[2-(3-pyridyl)ethyl]benzo[de]isoquinoline-1,3-dione CAS Name: 6-(phenylthio)-2-[2-(3-pyridinyl)ethyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 6-phenylsulfanyl-2-(2-pyridin-3-ylethyl)benzo[de]isoquinoline-1,3-dione Traditional Name: 6-(phenylthio)-2-[2-(3-pyridyl)ethyl]benzo[de]isoquinoline-1,3-quinone Formula: C25H18N2O2S MolecularWeight: 410.48762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=C3C=CC=C4C3=C(C=C2)C(=O)N(C4=O)CCC5=CN=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)SC2=C3C=CC=C4C3=C(C=C2)C(=O)N(C4=O)CCC5=CN=CC=C5

InChI

InChI=1S/C25H18N2O2S/c28-24-20-10-4-9-19-22(30-18-7-2-1-3-8-18)12-11-21(23(19)20)25(29)27(24)15-13-17-6-5-14-26-16-17/h1-12,14,16H,13,15H2