4-[[(4-methylsulfanylphenyl)amino]methylidene]-2-pyridin-2-yl-isoquinoline-1,3-dione

Systemtic Name: 4-[[(4-methylsulfanylphenyl)amino]methylidene]-2-pyridin-2-yl-isoquinoline-1,3-dione Openeye Name: 4-[(4-methylsulfanylanilino)methylene]-2-(2-pyridyl)isoquinoline-1,3-dione CAS Name: 4-[[4-(methylthio)anilino]methylidene]-2-(2-pyridinyl)isoquinoline-1,3-dione IUPAC Name: 4-[(4-methylsulfanylanilino)methylidene]-2-pyridin-2-ylisoquinoline-1,3-dione Traditional Name: 4-[[4-(methylthio)anilino]methylene]-2-(2-pyridyl)isoquinoline-1,3-quinone Formula: C22H17N3O2S MolecularWeight: 387.45428

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=N4

Isomeric SMILES

CSC1=CC=C(C=C1)NC=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=N4

InChI

InChI=1S/C22H17N3O2S/c1-28-16-11-9-15(10-12-16)24-14-19-17-6-2-3-7-18(17)21(26)25(22(19)27)20-8-4-5-13-23-20/h2-14,24H,1H3