2-[4-(2-methylsulfanyl-4-oxidanylidene-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl)butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-(2-methylsulfanyl-4-oxidanylidene-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl)butyl]isoindole-1,3-dione Openeye Name: 2-[4-(2-methylsulfanyl-4-oxo-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl)butyl]isoindoline-1,3-dione CAS Name: 2-[4-[2-(methylthio)-4-oxo-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-(2-methylsulfanyl-4-oxo-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl)butyl]isoindole-1,3-dione Traditional Name: 2-[4-[4-keto-2-(methylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl]butyl]isoindoline-1,3-quinone Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(CCC2)C(=O)N1CCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CSC1=NC2=C(CCC2)C(=O)N1CCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H21N3O3S/c1-27-20-21-16-10-6-9-15(16)19(26)23(20)12-5-4-11-22-17(24)13-7-2-3-8-14(13)18(22)25/h2-3,7-8H,4-6,9-12H2,1H3