N-[5-cyclopropyl-2-(5,6-dimethyl-4-oxidanylidene-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-phenyl-butanamide

Systemtic Name: N-[5-cyclopropyl-2-(5,6-dimethyl-4-oxidanylidene-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-phenyl-butanamide Openeye Name: N-[5-cyclopropyl-2-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-phenyl-butanamide CAS Name: N-[5-cyclopropyl-2-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)-3-pyrazolyl]-2-phenylbutanamide IUPAC Name: N-[5-cyclopropyl-2-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-phenylbutanamide Traditional Name: N-[5-cyclopropyl-2-(4-keto-5,6-dimethyl-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-phenyl-butyramide Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=CC(=NN2C3=NC(=O)C(=C(N3)C)C)C4CC4

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC2=CC(=NN2C3=NC(=O)C(=C(N3)C)C)C4CC4

InChI

InChI=1S/C22H25N5O2/c1-4-17(15-8-6-5-7-9-15)21(29)24-19-12-18(16-10-11-16)26-27(19)22-23-14(3)13(2)20(28)25-22/h5-9,12,16-17H,4,10-11H2,1-3H3,(H,24,29)(H,23,25,28)