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

Systemtic Name: 2,2-dimethyl-N-[2-(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]propanamide Openeye Name: 2,2-dimethyl-N-[2-(4-oxo-6-phenyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]propanamide CAS Name: 2,2-dimethyl-N-[2-(4-oxo-6-phenyl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-3-pyrazolyl]propanamide IUPAC Name: 2,2-dimethyl-N-[2-(4-oxo-6-phenyl-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]propanamide Traditional Name: N-[2-(4-keto-6-phenyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-2,2-dimethyl-propionamide Formula: C22H21N5O2S MolecularWeight: 419.49944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC(=NN1C2=NC(=O)C=C(N2)C3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC(=NN1C2=NC(=O)C=C(N2)C3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C22H21N5O2S/c1-22(2,3)20(29)24-18-12-16(17-10-7-11-30-17)26-27(18)21-23-15(13-19(28)25-21)14-8-5-4-6-9-14/h4-13H,1-3H3,(H,24,29)(H,23,25,28)