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

Systemtic Name: 6-propylsulfanyl-2-(2-pyridin-2-ylethyl)benzo[de]isoquinoline-1,3-dione Openeye Name: 6-propylsulfanyl-2-[2-(2-pyridyl)ethyl]benzo[de]isoquinoline-1,3-dione CAS Name: 6-(propylthio)-2-[2-(2-pyridinyl)ethyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 6-propylsulfanyl-2-(2-pyridin-2-ylethyl)benzo[de]isoquinoline-1,3-dione Traditional Name: 6-(propylthio)-2-[2-(2-pyridyl)ethyl]benzo[de]isoquinoline-1,3-quinone Formula: C22H20N2O2S MolecularWeight: 376.4714

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C2C=CC=C3C2=C(C=C1)C(=O)N(C3=O)CCC4=CC=CC=N4

Isomeric SMILES

CCCSC1=C2C=CC=C3C2=C(C=C1)C(=O)N(C3=O)CCC4=CC=CC=N4

InChI

InChI=1S/C22H20N2O2S/c1-2-14-27-19-10-9-18-20-16(19)7-5-8-17(20)21(25)24(22(18)26)13-11-15-6-3-4-12-23-15/h3-10,12H,2,11,13-14H2,1H3