2-[4-azanyl-5-[(5-ethylfuran-2-yl)methyl]pyrimidin-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[4-azanyl-5-[(5-ethylfuran-2-yl)methyl]pyrimidin-2-yl]sulfanylethanoic acid Openeye Name: 2-[4-amino-5-[(5-ethyl-2-furyl)methyl]pyrimidin-2-yl]sulfanylacetic acid CAS Name: 2-[[4-amino-5-[(5-ethyl-2-furanyl)methyl]-2-pyrimidinyl]thio]acetic acid IUPAC Name: 2-[4-amino-5-[(5-ethylfuran-2-yl)methyl]pyrimidin-2-yl]sulfanylacetic acid Traditional Name: 2-[[4-amino-5-[(5-ethyl-2-furyl)methyl]pyrimidin-2-yl]thio]acetic acid Formula: C13H15N3O3S MolecularWeight: 293.3415

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(O1)CC2=CN=C(N=C2N)SCC(=O)O

Isomeric SMILES

CCC1=CC=C(O1)CC2=CN=C(N=C2N)SCC(=O)O

InChI

InChI=1S/C13H15N3O3S/c1-2-9-3-4-10(19-9)5-8-6-15-13(16-12(8)14)20-7-11(17)18/h3-4,6H,2,5,7H2,1H3,(H,17,18)(H2,14,15,16)