ethyl 4-azanyl-2-[3-(4-cyanophenyl)propanoyloxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[3-(4-cyanophenyl)propanoyloxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[3-(4-cyanophenyl)propanoyloxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[3-(4-cyanophenyl)-1-oxopropoxy]methyl]-6-methyl-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[3-(4-cyanophenyl)propanoyloxymethyl]-6-methylfuro[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[3-(4-cyanophenyl)propanoyloxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C21H20N4O5 MolecularWeight: 408.4073

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)COC(=O)CCC3=CC=C(C=C3)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)COC(=O)CCC3=CC=C(C=C3)C#N)C

InChI

InChI=1S/C21H20N4O5/c1-3-28-21(27)17-12(2)30-20-18(17)19(23)24-15(25-20)11-29-16(26)9-8-13-4-6-14(10-22)7-5-13/h4-7H,3,8-9,11H2,1-2H3,(H2,23,24,25)