N-ethyl-5-[(2R)-1-[[2-(furan-2-yl)pyrimidin-5-yl]methyl]pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide

Systemtic Name: N-ethyl-5-[(2R)-1-[[2-(furan-2-yl)pyrimidin-5-yl]methyl]pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Openeye Name: N-ethyl-5-[(2R)-1-[[2-(2-furyl)pyrimidin-5-yl]methyl]pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide CAS Name: N-ethyl-5-[(2R)-1-[[2-(2-furanyl)-5-pyrimidinyl]methyl]-2-pyrrolidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: N-ethyl-5-[(2R)-1-[[2-(furan-2-yl)pyrimidin-5-yl]methyl]pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Traditional Name: N-ethyl-5-[(2R)-1-[[2-(2-furyl)pyrimidin-5-yl]methyl]pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Formula: C20H23N4O2S+ MolecularWeight: 383.48722

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC=C(S1)C2CCC[NH+]2CC3=CN=C(N=C3)C4=CC=CO4

Isomeric SMILES

CCNC(=O)C1=CC=C(S1)[C@H]2CCC[NH+]2CC3=CN=C(N=C3)C4=CC=CO4

InChI

InChI=1S/C20H22N4O2S/c1-2-21-20(25)18-8-7-17(27-18)15-5-3-9-24(15)13-14-11-22-19(23-12-14)16-6-4-10-26-16/h4,6-8,10-12,15H,2-3,5,9,13H2,1H3,(H,21,25)/p+1/t15-/m1/s1