2-(2-chloranyl-4-fluoranyl-phenyl)-4-[[(3-methylsulfanylphenyl)amino]methylidene]isoquinoline-1,3-dione

Systemtic Name: 2-(2-chloranyl-4-fluoranyl-phenyl)-4-[[(3-methylsulfanylphenyl)amino]methylidene]isoquinoline-1,3-dione Openeye Name: 2-(2-chloro-4-fluoro-phenyl)-4-[(3-methylsulfanylanilino)methylene]isoquinoline-1,3-dione CAS Name: 2-(2-chloro-4-fluorophenyl)-4-[[3-(methylthio)anilino]methylidene]isoquinoline-1,3-dione IUPAC Name: 2-(2-chloro-4-fluorophenyl)-4-[(3-methylsulfanylanilino)methylidene]isoquinoline-1,3-dione Traditional Name: 2-(2-chloro-4-fluoro-phenyl)-4-[[3-(methylthio)anilino]methylene]isoquinoline-1,3-quinone Formula: C23H16ClFN2O2S MolecularWeight: 438.901743

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H16ClFN2O2S/c1-30-16-6-4-5-15(12-16)26-13-19-17-7-2-3-8-18(17)22(28)27(23(19)29)21-10-9-14(25)11-20(21)24/h2-13,26H,1H3