5-azanyl-6-(furan-2-ylcarbonyl)-1-(2-morpholin-4-ium-4-ylethyl)thieno[2,3-d]pyrimidine-2,4-dione

Systemtic Name: 5-azanyl-6-(furan-2-ylcarbonyl)-1-(2-morpholin-4-ium-4-ylethyl)thieno[2,3-d]pyrimidine-2,4-dione Openeye Name: 5-amino-6-(furan-2-carbonyl)-1-(2-morpholin-4-ium-4-ylethyl)thieno[2,3-d]pyrimidine-2,4-dione CAS Name: 5-amino-6-[2-furanyl(oxo)methyl]-1-[2-(4-morpholin-4-iumyl)ethyl]thieno[2,3-d]pyrimidine-2,4-dione IUPAC Name: 5-amino-6-(furan-2-carbonyl)-1-(2-morpholin-4-ium-4-ylethyl)thieno[2,3-d]pyrimidine-2,4-dione Traditional Name: 5-amino-6-(2-furoyl)-1-(2-morpholin-4-ium-4-ylethyl)thieno[2,3-d]pyrimidine-2,4-quinone Formula: C17H19N4O5S+ MolecularWeight: 391.42156

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCN2C3=C(C(=C(S3)C(=O)C4=CC=CO4)N)C(=O)NC2=O

Isomeric SMILES

C1COCC[NH+]1CCN2C3=C(C(=C(S3)C(=O)C4=CC=CO4)N)C(=O)NC2=O

InChI

InChI=1S/C17H18N4O5S/c18-12-11-15(23)19-17(24)21(4-3-20-5-8-25-9-6-20)16(11)27-14(12)13(22)10-2-1-7-26-10/h1-2,7H,3-6,8-9,18H2,(H,19,23,24)/p+1