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

Systemtic Name: ethyl 4-azanyl-6-methyl-2-(2-quinoxalin-2-ylsulfanylethanoyloxymethyl)furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-6-methyl-2-[(2-quinoxalin-2-ylsulfanylacetyl)oxymethyl]furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-amino-6-methyl-2-[[1-oxo-2-(2-quinoxalinylthio)ethoxy]methyl]-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-6-methyl-2-[(2-quinoxalin-2-ylsulfanylacetyl)oxymethyl]furo[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-amino-6-methyl-2-[[2-(quinoxalin-2-ylthio)acetyl]oxymethyl]furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C21H19N5O5S MolecularWeight: 453.47106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)COC(=O)CSC3=NC4=CC=CC=C4N=C3)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)COC(=O)CSC3=NC4=CC=CC=C4N=C3)C

InChI

InChI=1S/C21H19N5O5S/c1-3-29-21(28)17-11(2)31-20-18(17)19(22)25-14(26-20)9-30-16(27)10-32-15-8-23-12-6-4-5-7-13(12)24-15/h4-8H,3,9-10H2,1-2H3,(H2,22,25,26)