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

Systemtic Name: 6-ethylsulfanyl-2-(2-pyridin-2-ylethyl)benzo[de]isoquinoline-1,3-dione Openeye Name: 6-ethylsulfanyl-2-[2-(2-pyridyl)ethyl]benzo[de]isoquinoline-1,3-dione CAS Name: 6-(ethylthio)-2-[2-(2-pyridinyl)ethyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 6-ethylsulfanyl-2-(2-pyridin-2-ylethyl)benzo[de]isoquinoline-1,3-dione Traditional Name: 6-(ethylthio)-2-[2-(2-pyridyl)ethyl]benzo[de]isoquinoline-1,3-quinone Formula: C21H18N2O2S MolecularWeight: 362.44482

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C2C=CC=C3C2=C(C=C1)C(=O)N(C3=O)CCC4=CC=CC=N4

Isomeric SMILES

CCSC1=C2C=CC=C3C2=C(C=C1)C(=O)N(C3=O)CCC4=CC=CC=N4

InChI

InChI=1S/C21H18N2O2S/c1-2-26-18-10-9-17-19-15(18)7-5-8-16(19)20(24)23(21(17)25)13-11-14-6-3-4-12-22-14/h3-10,12H,2,11,13H2,1H3