ethyl 4-azanyl-2-[(4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-yl)carbonyloxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[(4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-yl)carbonyloxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[(4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carbonyl)oxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[[4-cyano-2-methyl-5-(1-pyrrolyl)-3-furanyl]-oxomethoxy]methyl]-6-methyl-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[(4-cyano-2-methyl-5-pyrrol-1-ylfuran-3-carbonyl)oxymethyl]-6-methylfuro[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[(4-cyano-2-methyl-5-pyrrol-1-yl-3-furoyl)oxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C22H19N5O6 MolecularWeight: 449.41616

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)COC(=O)C3=C(OC(=C3C#N)N4C=CC=C4)C)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)COC(=O)C3=C(OC(=C3C#N)N4C=CC=C4)C)C

InChI

InChI=1S/C22H19N5O6/c1-4-30-22(29)16-12(3)32-19-17(16)18(24)25-14(26-19)10-31-21(28)15-11(2)33-20(13(15)9-23)27-7-5-6-8-27/h5-8H,4,10H2,1-3H3,(H2,24,25,26)