ethyl 4-azanyl-2-[[(2S)-2-benzamidopropanoyl]oxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[[(2S)-2-benzamidopropanoyl]oxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[[(2S)-2-benzamidopropanoyl]oxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[(2S)-2-benzamido-1-oxopropoxy]methyl]-6-methyl-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[[(2S)-2-benzamidopropanoyl]oxymethyl]-6-methylfuro[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[(2S)-2-benzamidopropanoyl]oxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C21H22N4O6 MolecularWeight: 426.42258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)COC(=O)[C@H](C)NC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C21H22N4O6/c1-4-29-21(28)15-12(3)31-19-16(15)17(22)24-14(25-19)10-30-20(27)11(2)23-18(26)13-8-6-5-7-9-13/h5-9,11H,4,10H2,1-3H3,(H,23,26)(H2,22,24,25)/t11-/m0/s1