(5R)-4-[(3,5-dimethyl-1H-pyrazol-4-yl)-oxidanyl-methylidene]-1-(3-imidazol-1-ylpropyl)-5-pyridin-2-yl-pyrrolidine-2,3-dione

Systemtic Name: (5R)-4-[(3,5-dimethyl-1H-pyrazol-4-yl)-oxidanyl-methylidene]-1-(3-imidazol-1-ylpropyl)-5-pyridin-2-yl-pyrrolidine-2,3-dione Openeye Name: (5R)-4-[(3,5-dimethyl-1H-pyrazol-4-yl)-hydroxy-methylene]-1-(3-imidazol-1-ylpropyl)-5-(2-pyridyl)pyrrolidine-2,3-dione CAS Name: (5R)-4-[(3,5-dimethyl-1H-pyrazol-4-yl)-hydroxymethylidene]-1-[3-(1-imidazolyl)propyl]-5-(2-pyridinyl)pyrrolidine-2,3-dione IUPAC Name: (5R)-4-[(3,5-dimethyl-1H-pyrazol-4-yl)-hydroxymethylidene]-1-(3-imidazol-1-ylpropyl)-5-pyridin-2-ylpyrrolidine-2,3-dione Traditional Name: (5R)-4-[(3,5-dimethyl-1H-pyrazol-4-yl)-hydroxy-methylene]-1-(3-imidazol-1-ylpropyl)-5-(2-pyridyl)pyrrolidine-2,3-quinone Formula: C21H22N6O3 MolecularWeight: 406.43778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)C(=C2C(N(C(=O)C2=O)CCCN3C=CN=C3)C4=CC=CC=N4)O

Isomeric SMILES

CC1=C(C(=NN1)C)C(=C2[C@@H](N(C(=O)C2=O)CCCN3C=CN=C3)C4=CC=CC=N4)O

InChI

InChI=1S/C21H22N6O3/c1-13-16(14(2)25-24-13)19(28)17-18(15-6-3-4-7-23-15)27(21(30)20(17)29)10-5-9-26-11-8-22-12-26/h3-4,6-8,11-12,18,28H,5,9-10H2,1-2H3,(H,24,25)/t18-/m0/s1