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

Systemtic Name: ethyl 4-azanyl-2-[(2-benzamido-4-methylsulfanyl-butanoyl)oxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[(2-benzamido-4-methylsulfanyl-butanoyl)oxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[2-benzamido-4-(methylthio)-1-oxobutoxy]methyl]-6-methyl-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[(2-benzamido-4-methylsulfanylbutanoyl)oxymethyl]-6-methylfuro[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[2-benzamido-4-(methylthio)butanoyl]oxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C23H26N4O6S MolecularWeight: 486.54074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N4O6S/c1-4-31-23(30)17-13(2)33-21-18(17)19(24)26-16(27-21)12-32-22(29)15(10-11-34-3)25-20(28)14-8-6-5-7-9-14/h5-9,15H,4,10-12H2,1-3H3,(H,25,28)(H2,24,26,27)