ethyl 4-azanyl-6-methyl-2-[2-[(3-methylphenyl)carbonylamino]ethanoyloxymethyl]furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-6-methyl-2-[2-[(3-methylphenyl)carbonylamino]ethanoyloxymethyl]furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-6-methyl-2-[[2-[(3-methylbenzoyl)amino]acetyl]oxymethyl]furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-amino-6-methyl-2-[[2-[[(3-methylphenyl)-oxomethyl]amino]-1-oxoethoxy]methyl]-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-6-methyl-2-[[2-[(3-methylbenzoyl)amino]acetyl]oxymethyl]furo[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-amino-6-methyl-2-[[2-(m-toluoylamino)acetyl]oxymethyl]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)CNC(=O)C3=CC(=CC=C3)C)C

Isomeric SMILES

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

InChI

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