(4E)-4-[(4-methylsulfanylphenyl)methylidene]isoquinoline-1,3-dione

Systemtic Name: (4E)-4-[(4-methylsulfanylphenyl)methylidene]isoquinoline-1,3-dione Openeye Name: (4E)-4-[(4-methylsulfanylphenyl)methylene]isoquinoline-1,3-dione CAS Name: (4E)-4-[[4-(methylthio)phenyl]methylidene]isoquinoline-1,3-dione IUPAC Name: (4E)-4-[(4-methylsulfanylphenyl)methylidene]isoquinoline-1,3-dione Traditional Name: (4E)-4-[4-(methylthio)benzylidene]isoquinoline-1,3-quinone Formula: C17H13NO2S MolecularWeight: 295.35562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=C2C3=CC=CC=C3C(=O)NC2=O

Isomeric SMILES

CSC1=CC=C(C=C1)/C=C/2\C3=CC=CC=C3C(=O)NC2=O

InChI

InChI=1S/C17H13NO2S/c1-21-12-8-6-11(7-9-12)10-15-13-4-2-3-5-14(13)16(19)18-17(15)20/h2-10H,1H3,(H,18,19,20)/b15-10+