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

Systemtic Name: 2-[[2,6-bis(methylsulfanyl)pyrimidin-4-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[[2,6-bis(methylsulfanyl)pyrimidin-4-yl]methyl]isoindoline-1,3-dione CAS Name: 2-[[2,6-bis(methylthio)-4-pyrimidinyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[2,6-bis(methylsulfanyl)pyrimidin-4-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[2,6-bis(methylthio)pyrimidin-4-yl]methyl]isoindoline-1,3-quinone Formula: C15H13N3O2S2 MolecularWeight: 331.41262

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC(=C1)CN2C(=O)C3=CC=CC=C3C2=O)SC

Isomeric SMILES

CSC1=NC(=NC(=C1)CN2C(=O)C3=CC=CC=C3C2=O)SC

InChI

InChI=1S/C15H13N3O2S2/c1-21-12-7-9(16-15(17-12)22-2)8-18-13(19)10-5-3-4-6-11(10)14(18)20/h3-7H,8H2,1-2H3