3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2R)-3-methyl-1-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)butan-2-yl]propanamide

Systemtic Name: 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2R)-3-methyl-1-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)butan-2-yl]propanamide Openeye Name: 3-(3,5-dimethylisoxazol-4-yl)-N-[(1R)-2-methyl-1-[[6-oxo-3-(2-thienyl)pyridazin-1-yl]methyl]propyl]propanamide CAS Name: 3-(3,5-dimethyl-4-isoxazolyl)-N-[(2R)-3-methyl-1-(6-oxo-3-thiophen-2-yl-1-pyridazinyl)butan-2-yl]propanamide IUPAC Name: 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2R)-3-methyl-1-(6-oxo-3-thiophen-2-ylpyridazin-1-yl)butan-2-yl]propanamide Traditional Name: 3-(3,5-dimethylisoxazol-4-yl)-N-[(1R)-1-[[6-keto-3-(2-thienyl)pyridazin-1-yl]methyl]-2-methyl-propyl]propionamide Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CCC(=O)NC(CN2C(=O)C=CC(=N2)C3=CC=CS3)C(C)C

Isomeric SMILES

CC1=C(C(=NO1)C)CCC(=O)N[C@@H](CN2C(=O)C=CC(=N2)C3=CC=CS3)C(C)C

InChI

InChI=1S/C21H26N4O3S/c1-13(2)18(22-20(26)9-7-16-14(3)24-28-15(16)4)12-25-21(27)10-8-17(23-25)19-6-5-11-29-19/h5-6,8,10-11,13,18H,7,9,12H2,1-4H3,(H,22,26)/t18-/m0/s1