2-isoquinolin-1-ylsulfanyl-1-(4-methoxyphenyl)ethanone

Systemtic Name: 2-isoquinolin-1-ylsulfanyl-1-(4-methoxyphenyl)ethanone Openeye Name: 2-(1-isoquinolylsulfanyl)-1-(4-methoxyphenyl)ethanone CAS Name: 2-(1-isoquinolinylthio)-1-(4-methoxyphenyl)ethanone IUPAC Name: 2-isoquinolin-1-ylsulfanyl-1-(4-methoxyphenyl)ethanone Traditional Name: 2-(1-isoquinolylthio)-1-(4-methoxyphenyl)ethanone Formula: C18H15NO2S MolecularWeight: 309.3822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CSC2=NC=CC3=CC=CC=C32

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CSC2=NC=CC3=CC=CC=C32

InChI

InChI=1S/C18H15NO2S/c1-21-15-8-6-14(7-9-15)17(20)12-22-18-16-5-3-2-4-13(16)10-11-19-18/h2-11H,12H2,1H3