ethyl 4-azanyl-6-methyl-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanylmethyl]furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-6-methyl-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanylmethyl]furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-6-methyl-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanylmethyl]furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-amino-6-methyl-2-[[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]methyl]-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-6-methyl-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanylmethyl]furo[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]methyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C18H21N5O4S MolecularWeight: 403.45544

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC2=NC(=C3C(=C(OC3=N2)C)C(=O)OCC)N

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC2=NC(=C3C(=C(OC3=N2)C)C(=O)OCC)N

InChI

InChI=1S/C18H21N5O4S/c1-4-6-10-7-12(24)23-18(20-10)28-8-11-21-15(19)14-13(17(25)26-5-2)9(3)27-16(14)22-11/h7H,4-6,8H2,1-3H3,(H2,19,21,22)(H,20,23,24)