5-[(2S)-1-[(2,4-dimethoxypyrimidin-5-yl)methyl]pyrrolidin-1-ium-2-yl]-N,N-dimethyl-thiophene-2-carboxamide

Systemtic Name: 5-[(2S)-1-[(2,4-dimethoxypyrimidin-5-yl)methyl]pyrrolidin-1-ium-2-yl]-N,N-dimethyl-thiophene-2-carboxamide Openeye Name: 5-[(2S)-1-[(2,4-dimethoxypyrimidin-5-yl)methyl]pyrrolidin-1-ium-2-yl]-N,N-dimethyl-thiophene-2-carboxamide CAS Name: 5-[(2S)-1-[(2,4-dimethoxy-5-pyrimidinyl)methyl]-2-pyrrolidin-1-iumyl]-N,N-dimethyl-2-thiophenecarboxamide IUPAC Name: 5-[(2S)-1-[(2,4-dimethoxypyrimidin-5-yl)methyl]pyrrolidin-1-ium-2-yl]-N,N-dimethylthiophene-2-carboxamide Traditional Name: 5-[(2S)-1-[(2,4-dimethoxypyrimidin-5-yl)methyl]pyrrolidin-1-ium-2-yl]-N,N-dimethyl-thiophene-2-carboxamide Formula: C18H25N4O3S+ MolecularWeight: 377.4811

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=C(S1)C2CCC[NH+]2CC3=CN=C(N=C3OC)OC

Isomeric SMILES

CN(C)C(=O)C1=CC=C(S1)[C@@H]2CCC[NH+]2CC3=CN=C(N=C3OC)OC

InChI

InChI=1S/C18H24N4O3S/c1-21(2)17(23)15-8-7-14(26-15)13-6-5-9-22(13)11-12-10-19-18(25-4)20-16(12)24-3/h7-8,10,13H,5-6,9,11H2,1-4H3/p+1/t13-/m0/s1