3-[2-(cyclopentylamino)-6-propan-2-yl-pyrimidin-4-yl]-N-phenyl-1,2-oxazole-5-carboxamide

Systemtic Name: 3-[2-(cyclopentylamino)-6-propan-2-yl-pyrimidin-4-yl]-N-phenyl-1,2-oxazole-5-carboxamide Openeye Name: 3-[2-(cyclopentylamino)-6-isopropyl-pyrimidin-4-yl]-N-phenyl-isoxazole-5-carboxamide CAS Name: 3-[2-(cyclopentylamino)-6-propan-2-yl-4-pyrimidinyl]-N-phenyl-5-isoxazolecarboxamide IUPAC Name: 3-[2-(cyclopentylamino)-6-propan-2-ylpyrimidin-4-yl]-N-phenyl-1,2-oxazole-5-carboxamide Traditional Name: 3-[2-(cyclopentylamino)-6-isopropyl-pyrimidin-4-yl]-N-phenyl-isoxazole-5-carboxamide Formula: C22H25N5O2 MolecularWeight: 391.4662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NC(=C1)C2=NOC(=C2)C(=O)NC3=CC=CC=C3)NC4CCCC4

Isomeric SMILES

CC(C)C1=NC(=NC(=C1)C2=NOC(=C2)C(=O)NC3=CC=CC=C3)NC4CCCC4

InChI

InChI=1S/C22H25N5O2/c1-14(2)17-12-18(26-22(25-17)24-16-10-6-7-11-16)19-13-20(29-27-19)21(28)23-15-8-4-3-5-9-15/h3-5,8-9,12-14,16H,6-7,10-11H2,1-2H3,(H,23,28)(H,24,25,26)