2-(furan-2-yl)-4,5-dimethyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 2-(furan-2-yl)-4,5-dimethyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 2-(2-furyl)-N-(1-isopropylpiperidin-1-ium-4-yl)-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 2-(2-furanyl)-4,5-dimethyl-N-(1-propan-2-yl-4-piperidin-1-iumyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 2-(furan-2-yl)-4,5-dimethyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 2-(2-furyl)-N-(1-isopropylpiperidin-1-ium-4-yl)-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H27N4O2S+ MolecularWeight: 399.52968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)C)C3=CC=CO3)C(=O)NC4CC[NH+](CC4)C(C)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)C)C3=CC=CO3)C(=O)NC4CC[NH+](CC4)C(C)C

InChI

InChI=1S/C21H26N4O2S/c1-12(2)25-9-7-15(8-10-25)23-20(26)18-13(3)17-14(4)22-19(24-21(17)28-18)16-6-5-11-27-16/h5-6,11-12,15H,7-10H2,1-4H3,(H,23,26)/p+1