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

Systemtic Name: 6-ethylsulfanyl-2-(phenylmethyl)benzo[de]isoquinoline-1,3-dione Openeye Name: 2-benzyl-6-ethylsulfanyl-benzo[de]isoquinoline-1,3-dione CAS Name: 6-(ethylthio)-2-(phenylmethyl)benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-benzyl-6-ethylsulfanylbenzo[de]isoquinoline-1,3-dione Traditional Name: 2-benzyl-6-(ethylthio)benzo[de]isoquinoline-1,3-quinone Formula: C21H17NO2S MolecularWeight: 347.43018

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C2C=CC=C3C2=C(C=C1)C(=O)N(C3=O)CC4=CC=CC=C4

Isomeric SMILES

CCSC1=C2C=CC=C3C2=C(C=C1)C(=O)N(C3=O)CC4=CC=CC=C4

InChI

InChI=1S/C21H17NO2S/c1-2-25-18-12-11-17-19-15(18)9-6-10-16(19)20(23)22(21(17)24)13-14-7-4-3-5-8-14/h3-12H,2,13H2,1H3