[5-(furan-2-yl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]methyl-methyl-(phenylmethyl)azanium

Systemtic Name: [5-(furan-2-yl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[5-(2-furyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methyl]-methyl-ammonium CAS Name: [5-(2-furanyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[5-(furan-2-yl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methyl]-methylazanium Traditional Name: benzyl-[[5-(2-furyl)-4-keto-3H-thieno[2,3-d]pyrimidin-2-yl]methyl]-methyl-ammonium Formula: C19H18N3O2S+ MolecularWeight: 352.43012

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC2=NC3=C(C(=CS3)C4=CC=CO4)C(=O)N2

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC2=NC3=C(C(=CS3)C4=CC=CO4)C(=O)N2

InChI

InChI=1S/C19H17N3O2S/c1-22(10-13-6-3-2-4-7-13)11-16-20-18(23)17-14(12-25-19(17)21-16)15-8-5-9-24-15/h2-9,12H,10-11H2,1H3,(H,20,21,23)/p+1