3-azanyl-2-(4-methylsulfanylphenyl)isoquinolin-1-one

Systemtic Name: 3-azanyl-2-(4-methylsulfanylphenyl)isoquinolin-1-one Openeye Name: 3-amino-2-(4-methylsulfanylphenyl)isoquinolin-1-one CAS Name: 3-amino-2-[4-(methylthio)phenyl]-1-isoquinolinone IUPAC Name: 3-amino-2-(4-methylsulfanylphenyl)isoquinolin-1-one Traditional Name: 3-amino-2-[4-(methylthio)phenyl]isocarbostyril Formula: C16H14N2OS MolecularWeight: 282.36016

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)N2C(=CC3=CC=CC=C3C2=O)N

Isomeric SMILES

CSC1=CC=C(C=C1)N2C(=CC3=CC=CC=C3C2=O)N

InChI

InChI=1S/C16H14N2OS/c1-20-13-8-6-12(7-9-13)18-15(17)10-11-4-2-3-5-14(11)16(18)19/h2-10H,17H2,1H3