3-ethylsulfanyl-2-(phenylmethyl)isoquinolin-1-one

Systemtic Name: 3-ethylsulfanyl-2-(phenylmethyl)isoquinolin-1-one Openeye Name: 2-benzyl-3-ethylsulfanyl-isoquinolin-1-one CAS Name: 3-(ethylthio)-2-(phenylmethyl)-1-isoquinolinone IUPAC Name: 2-benzyl-3-ethylsulfanylisoquinolin-1-one Traditional Name: 2-benzyl-3-(ethylthio)isocarbostyril Formula: C18H17NOS MolecularWeight: 295.39868

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3

Isomeric SMILES

CCSC1=CC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3

InChI

InChI=1S/C18H17NOS/c1-2-21-17-12-15-10-6-7-11-16(15)18(20)19(17)13-14-8-4-3-5-9-14/h3-12H,2,13H2,1H3