ethyl 4-azanyl-2-[(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonyloxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonyloxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[(5-chloro-2-methylsulfanyl-pyrimidine-4-carbonyl)oxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[[5-chloro-2-(methylthio)-4-pyrimidinyl]-oxomethoxy]methyl]-6-methyl-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[(5-chloro-2-methylsulfanylpyrimidine-4-carbonyl)oxymethyl]-6-methylfuro[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[5-chloro-2-(methylthio)pyrimidine-4-carbonyl]oxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C17H16ClN5O5S MolecularWeight: 437.85744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)COC(=O)C3=NC(=NC=C3Cl)SC)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)COC(=O)C3=NC(=NC=C3Cl)SC)C

InChI

InChI=1S/C17H16ClN5O5S/c1-4-26-15(24)10-7(2)28-14-11(10)13(19)21-9(22-14)6-27-16(25)12-8(18)5-20-17(23-12)29-3/h5H,4,6H2,1-3H3,(H2,19,21,22)