2-[3-(2-methyl-4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-(2-methyl-4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)propyl]isoindole-1,3-dione Openeye Name: 2-[3-(2-methyl-4-oxo-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)propyl]isoindoline-1,3-dione CAS Name: 2-[3-(2-methyl-4-oxo-6-phenyl-3-thieno[2,3-d]pyrimidinyl)propyl]isoindole-1,3-dione IUPAC Name: 2-[3-(2-methyl-4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)propyl]isoindole-1,3-dione Traditional Name: 2-[3-(4-keto-2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)propyl]isoindoline-1,3-quinone Formula: C24H19N3O3S MolecularWeight: 429.49096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)N1CCCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC1=NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)N1CCCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C24H19N3O3S/c1-15-25-21-19(14-20(31-21)16-8-3-2-4-9-16)24(30)26(15)12-7-13-27-22(28)17-10-5-6-11-18(17)23(27)29/h2-6,8-11,14H,7,12-13H2,1H3