2-[(6-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)methyl]isoindole-1,3-dione

Systemtic Name: 2-[(6-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)methyl]isoindole-1,3-dione Openeye Name: 2-[(6-chloro-2-methylsulfanyl-pyrimidin-4-yl)methyl]isoindoline-1,3-dione CAS Name: 2-[[6-chloro-2-(methylthio)-4-pyrimidinyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[(6-chloro-2-methylsulfanylpyrimidin-4-yl)methyl]isoindole-1,3-dione Traditional Name: 2-[[6-chloro-2-(methylthio)pyrimidin-4-yl]methyl]isoindoline-1,3-quinone Formula: C14H10ClN3O2S MolecularWeight: 319.7661

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=CC(=N1)Cl)CN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CSC1=NC(=CC(=N1)Cl)CN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C14H10ClN3O2S/c1-21-14-16-8(6-11(15)17-14)7-18-12(19)9-4-2-3-5-10(9)13(18)20/h2-6H,7H2,1H3