2-(furan-2-yl)-4,5-dimethyl-N-(3-morpholin-4-ium-4-ylpropyl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 2-(furan-2-yl)-4,5-dimethyl-N-(3-morpholin-4-ium-4-ylpropyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 2-(2-furyl)-4,5-dimethyl-N-(3-morpholin-4-ium-4-ylpropyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 2-(2-furanyl)-4,5-dimethyl-N-[3-(4-morpholin-4-iumyl)propyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 2-(furan-2-yl)-4,5-dimethyl-N-(3-morpholin-4-ium-4-ylpropyl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 2-(2-furyl)-4,5-dimethyl-N-(3-morpholin-4-ium-4-ylpropyl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C20H25N4O3S+ MolecularWeight: 401.5025

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)C)C3=CC=CO3)C(=O)NCCC[NH+]4CCOCC4

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)C)C3=CC=CO3)C(=O)NCCC[NH+]4CCOCC4

InChI

InChI=1S/C20H24N4O3S/c1-13-16-14(2)22-18(15-5-3-10-27-15)23-20(16)28-17(13)19(25)21-6-4-7-24-8-11-26-12-9-24/h3,5,10H,4,6-9,11-12H2,1-2H3,(H,21,25)/p+1