methyl 5-[[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylmethyl]-3-methyl-furan-2-carboxylate

Systemtic Name: methyl 5-[[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylmethyl]-3-methyl-furan-2-carboxylate Openeye Name: methyl 5-[(4,6-diaminopyrimidin-2-yl)sulfanylmethyl]-3-methyl-furan-2-carboxylate CAS Name: 5-[[(4,6-diamino-2-pyrimidinyl)thio]methyl]-3-methyl-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(4,6-diaminopyrimidin-2-yl)sulfanylmethyl]-3-methylfuran-2-carboxylate Traditional Name: 5-[[(4,6-diaminopyrimidin-2-yl)thio]methyl]-3-methyl-furan-2-carboxylic acid methyl ester Formula: C12H14N4O3S MolecularWeight: 294.32956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)CSC2=NC(=CC(=N2)N)N)C(=O)OC

Isomeric SMILES

CC1=C(OC(=C1)CSC2=NC(=CC(=N2)N)N)C(=O)OC

InChI

InChI=1S/C12H14N4O3S/c1-6-3-7(19-10(6)11(17)18-2)5-20-12-15-8(13)4-9(14)16-12/h3-4H,5H2,1-2H3,(H4,13,14,15,16)