N-[5-(furan-2-yl)-2-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)pyrazol-3-yl]-4-phenyl-butanamide

Systemtic Name: N-[5-(furan-2-yl)-2-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)pyrazol-3-yl]-4-phenyl-butanamide Openeye Name: N-[5-(2-furyl)-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]-4-phenyl-butanamide CAS Name: N-[5-(2-furanyl)-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)-3-pyrazolyl]-4-phenylbutanamide IUPAC Name: N-[5-(furan-2-yl)-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]-4-phenylbutanamide Traditional Name: N-[5-(2-furyl)-2-(4-keto-6-methyl-1H-pyrimidin-2-yl)pyrazol-3-yl]-4-phenyl-butyramide Formula: C22H21N5O3 MolecularWeight: 403.43384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CO3)NC(=O)CCCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CO3)NC(=O)CCCC4=CC=CC=C4

InChI

InChI=1S/C22H21N5O3/c1-15-13-21(29)25-22(23-15)27-19(14-17(26-27)18-10-6-12-30-18)24-20(28)11-5-9-16-7-3-2-4-8-16/h2-4,6-8,10,12-14H,5,9,11H2,1H3,(H,24,28)(H,23,25,29)