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

Systemtic Name: 2-[2-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]ethyl]isoindoline-1,3-quinone Formula: C15H13N3O3S MolecularWeight: 315.34702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C15H13N3O3S/c1-9-8-12(19)17-15(16-9)22-7-6-18-13(20)10-4-2-3-5-11(10)14(18)21/h2-5,8H,6-7H2,1H3,(H,16,17,19)