3-oxidanylidene-N-(5-phenylpyrimidin-2-yl)spiro[2-benzofuran-1,4'-cyclohexane]-1'-carboxamide

Systemtic Name: 3-oxidanylidene-N-(5-phenylpyrimidin-2-yl)spiro[2-benzofuran-1,4'-cyclohexane]-1'-carboxamide Openeye Name: 3'-oxo-N-(5-phenylpyrimidin-2-yl)spiro[cyclohexane-4,1'-isobenzofuran]-1-carboxamide CAS Name: 3'-oxo-N-(5-phenyl-2-pyrimidinyl)-1-spiro[cyclohexane-4,1'-isobenzofuran]carboxamide IUPAC Name: 3-oxo-N-(5-phenylpyrimidin-2-yl)spiro[2-benzofuran-1,4'-cyclohexane]-1'-carboxamide Traditional Name: 3'-keto-N-(5-phenylpyrimidin-2-yl)spiro[cyclohexane-4,1'-phthalan]-1-carboxamide Formula: C24H21N3O3 MolecularWeight: 399.44184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCC1C(=O)NC3=NC=C(C=N3)C4=CC=CC=C4)C5=CC=CC=C5C(=O)O2

Isomeric SMILES

C1CC2(CCC1C(=O)NC3=NC=C(C=N3)C4=CC=CC=C4)C5=CC=CC=C5C(=O)O2

InChI

InChI=1S/C24H21N3O3/c28-21(27-23-25-14-18(15-26-23)16-6-2-1-3-7-16)17-10-12-24(13-11-17)20-9-5-4-8-19(20)22(29)30-24/h1-9,14-15,17H,10-13H2,(H,25,26,27,28)