2-[[furan-2-ylmethyl(methyl)azaniumyl]methyl]thieno[3,2-d]pyrimidin-4-olate

Systemtic Name: 2-[[furan-2-ylmethyl(methyl)azaniumyl]methyl]thieno[3,2-d]pyrimidin-4-olate Openeye Name: 2-[[2-furylmethyl(methyl)ammonio]methyl]thieno[3,2-d]pyrimidin-4-olate CAS Name: 2-[[2-furanylmethyl(methyl)ammonio]methyl]-4-thieno[3,2-d]pyrimidinolate IUPAC Name: 2-[[furan-2-ylmethyl(methyl)azaniumyl]methyl]thieno[3,2-d]pyrimidin-4-olate Traditional Name: 2-[[2-furfuryl(methyl)ammonio]methyl]thieno[3,2-d]pyrimidin-4-olate Formula: C13H13N3O2S MolecularWeight: 275.32622

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CO1)CC2=NC3=C(C(=N2)[O-])SC=C3

Isomeric SMILES

C[NH+](CC1=CC=CO1)CC2=NC3=C(C(=N2)[O-])SC=C3

InChI

InChI=1S/C13H13N3O2S/c1-16(7-9-3-2-5-18-9)8-11-14-10-4-6-19-12(10)13(17)15-11/h2-6H,7-8H2,1H3,(H,14,15,17)