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

Systemtic Name: cyclohexyl-[[5-(furan-2-yl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]methyl]-methyl-azanium Openeye Name: cyclohexyl-[[5-(2-furyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methyl]-methyl-ammonium CAS Name: cyclohexyl-[[5-(2-furanyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methyl]-methylammonium IUPAC Name: cyclohexyl-[[5-(furan-2-yl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methyl]-methylazanium Traditional Name: cyclohexyl-[[5-(2-furyl)-4-keto-3H-thieno[2,3-d]pyrimidin-2-yl]methyl]-methyl-ammonium Formula: C18H22N3O2S+ MolecularWeight: 344.45118

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC2=C(C(=CS2)C3=CC=CO3)C(=O)N1)C4CCCCC4

Isomeric SMILES

C[NH+](CC1=NC2=C(C(=CS2)C3=CC=CO3)C(=O)N1)C4CCCCC4

InChI

InChI=1S/C18H21N3O2S/c1-21(12-6-3-2-4-7-12)10-15-19-17(22)16-13(11-24-18(16)20-15)14-8-5-9-23-14/h5,8-9,11-12H,2-4,6-7,10H2,1H3,(H,19,20,22)/p+1