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

Systemtic Name: 2-[2-(4-methyl-2-methylsulfanyl-6-oxidanylidene-pyrimidin-1-yl)ethyl]isoindole-1,3-dione Openeye Name: 2-[2-(4-methyl-2-methylsulfanyl-6-oxo-pyrimidin-1-yl)ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[4-methyl-2-(methylthio)-6-oxo-1-pyrimidinyl]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(4-methyl-2-methylsulfanyl-6-oxopyrimidin-1-yl)ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[6-keto-4-methyl-2-(methylthio)pyrimidin-1-yl]ethyl]isoindoline-1,3-quinone Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=N1)SC)CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC(=O)N(C(=N1)SC)CCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C16H15N3O3S/c1-10-9-13(20)18(16(17-10)23-2)7-8-19-14(21)11-5-3-4-6-12(11)15(19)22/h3-6,9H,7-8H2,1-2H3