(4E)-1-(2-dimethylaminoethyl)-4-[(2,4-dimethylpyrimidin-5-yl)-oxidanyl-methylidene]-5-pyridin-4-yl-pyrrolidine-2,3-dione

Systemtic Name: (4E)-1-(2-dimethylaminoethyl)-4-[(2,4-dimethylpyrimidin-5-yl)-oxidanyl-methylidene]-5-pyridin-4-yl-pyrrolidine-2,3-dione Openeye Name: (4E)-1-(2-dimethylaminoethyl)-4-[(2,4-dimethylpyrimidin-5-yl)-hydroxy-methylene]-5-(4-pyridyl)pyrrolidine-2,3-dione CAS Name: (4E)-1-(2-dimethylaminoethyl)-4-[(2,4-dimethyl-5-pyrimidinyl)-hydroxymethylidene]-5-pyridin-4-ylpyrrolidine-2,3-dione IUPAC Name: (4E)-1-(2-dimethylaminoethyl)-4-[(2,4-dimethylpyrimidin-5-yl)-hydroxymethylidene]-5-pyridin-4-ylpyrrolidine-2,3-dione Traditional Name: (4E)-1-(2-dimethylaminoethyl)-4-[(2,4-dimethylpyrimidin-5-yl)-hydroxy-methylene]-5-(4-pyridyl)pyrrolidine-2,3-quinone Formula: C20H23N5O3 MolecularWeight: 381.42832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=C2C(N(C(=O)C2=O)CCN(C)C)C3=CC=NC=C3)O)C

Isomeric SMILES

CC1=NC(=NC=C1/C(=C\2/C(N(C(=O)C2=O)CCN(C)C)C3=CC=NC=C3)/O)C

InChI

InChI=1S/C20H23N5O3/c1-12-15(11-22-13(2)23-12)18(26)16-17(14-5-7-21-8-6-14)25(10-9-24(3)4)20(28)19(16)27/h5-8,11,17,26H,9-10H2,1-4H3/b18-16+