2-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5-methyl-7-(2-methylpropyl)-3-[(4-oxidanyl-1,2-oxazolidin-2-yl)carbonyl]thieno[2,3-d]pyridazin-4-one

Systemtic Name: 2-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5-methyl-7-(2-methylpropyl)-3-[(4-oxidanyl-1,2-oxazolidin-2-yl)carbonyl]thieno[2,3-d]pyridazin-4-one Openeye Name: 2-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3-(4-hydroxyisoxazolidine-2-carbonyl)-7-isobutyl-5-methyl-thieno[2,3-d]pyridazin-4-one CAS Name: 2-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3-[(4-hydroxy-2-isoxazolidinyl)-oxomethyl]-5-methyl-7-(2-methylpropyl)-4-thieno[2,3-d]pyridazinone IUPAC Name: 2-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3-(4-hydroxy-1,2-oxazolidine-2-carbonyl)-5-methyl-7-(2-methylpropyl)thieno[2,3-d]pyridazin-4-one Traditional Name: 2-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3-(4-hydroxyisoxazolidine-2-carbonyl)-7-isobutyl-5-methyl-thieno[2,3-d]pyridazin-4-one Formula: C21H27N5O4S MolecularWeight: 445.53518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)CC2=C(C3=C(S2)C(=NN(C3=O)C)CC(C)C)C(=O)N4CC(CO4)O

Isomeric SMILES

CC1=C(C(=NN1)C)CC2=C(C3=C(S2)C(=NN(C3=O)C)CC(C)C)C(=O)N4CC(CO4)O

InChI

InChI=1S/C21H27N5O4S/c1-10(2)6-15-19-18(20(28)25(5)24-15)17(21(29)26-8-13(27)9-30-26)16(31-19)7-14-11(3)22-23-12(14)4/h10,13,27H,6-9H2,1-5H3,(H,22,23)