ethyl 4-azanyl-6-methyl-2-[[4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanoyl]oxymethyl]furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-6-methyl-2-[[4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanoyl]oxymethyl]furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-6-methyl-2-[[4-(5-methyl-2-thienyl)-4-oxo-butanoyl]oxymethyl]furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-amino-6-methyl-2-[[4-(5-methyl-2-thiophenyl)-1,4-dioxobutoxy]methyl]-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-6-methyl-2-[[4-(5-methylthiophen-2-yl)-4-oxobutanoyl]oxymethyl]furo[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[4-keto-4-(5-methyl-2-thienyl)butanoyl]oxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C20H21N3O6S MolecularWeight: 431.46224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)COC(=O)CCC(=O)C3=CC=C(S3)C)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)COC(=O)CCC(=O)C3=CC=C(S3)C)C

InChI

InChI=1S/C20H21N3O6S/c1-4-27-20(26)16-11(3)29-19-17(16)18(21)22-14(23-19)9-28-15(25)8-6-12(24)13-7-5-10(2)30-13/h5,7H,4,6,8-9H2,1-3H3,(H2,21,22,23)