N-(2-cyanoethyl)-2-methoxy-N-[1-[3-methyl-4-oxidanylidene-5-(phenylmethyl)-[1,2]oxazolo[5,4-d]pyrimidin-6-yl]propyl]ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-methoxy-N-[1-[3-methyl-4-oxidanylidene-5-(phenylmethyl)-[1,2]oxazolo[5,4-d]pyrimidin-6-yl]propyl]ethanamide Openeye Name: N-[1-(5-benzyl-3-methyl-4-oxo-isoxazolo[5,4-d]pyrimidin-6-yl)propyl]-N-(2-cyanoethyl)-2-methoxy-acetamide CAS Name: N-(2-cyanoethyl)-2-methoxy-N-[1-[3-methyl-4-oxo-5-(phenylmethyl)-6-isoxazolo[5,4-d]pyrimidinyl]propyl]acetamide IUPAC Name: N-[1-(5-benzyl-3-methyl-4-oxo-[1,2]oxazolo[5,4-d]pyrimidin-6-yl)propyl]-N-(2-cyanoethyl)-2-methoxyacetamide Traditional Name: N-[1-(5-benzyl-4-keto-3-methyl-isoxazolo[5,4-d]pyrimidin-6-yl)propyl]-N-(2-cyanoethyl)-2-methoxy-acetamide Formula: C22H25N5O4 MolecularWeight: 423.465

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=C(C(=NO2)C)C(=O)N1CC3=CC=CC=C3)N(CCC#N)C(=O)COC

Isomeric SMILES

CCC(C1=NC2=C(C(=NO2)C)C(=O)N1CC3=CC=CC=C3)N(CCC#N)C(=O)COC

InChI

InChI=1S/C22H25N5O4/c1-4-17(26(12-8-11-23)18(28)14-30-3)20-24-21-19(15(2)25-31-21)22(29)27(20)13-16-9-6-5-7-10-16/h5-7,9-10,17H,4,8,12-14H2,1-3H3