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

Systemtic Name: ethyl 4-azanyl-6-methyl-2-[(2-methylsulfanylphenyl)carbonyloxymethyl]furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-6-methyl-2-[(2-methylsulfanylbenzoyl)oxymethyl]furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-amino-6-methyl-2-[[[2-(methylthio)phenyl]-oxomethoxy]methyl]-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-6-methyl-2-[(2-methylsulfanylbenzoyl)oxymethyl]furo[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-amino-6-methyl-2-[[2-(methylthio)benzoyl]oxymethyl]furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)COC(=O)C3=CC=CC=C3SC)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)COC(=O)C3=CC=CC=C3SC)C

InChI

InChI=1S/C19H19N3O5S/c1-4-25-19(24)14-10(2)27-17-15(14)16(20)21-13(22-17)9-26-18(23)11-7-5-6-8-12(11)28-3/h5-8H,4,9H2,1-3H3,(H2,20,21,22)