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

Systemtic Name: 5-[(2R)-1-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Openeye Name: 5-[(2R)-1-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide CAS Name: 5-[(2R)-1-[[1-(2-pyrimidinyl)-2-pyrrolyl]methyl]-2-pyrrolidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: 5-[(2R)-1-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Traditional Name: 5-[(2R)-1-[[1-(2-pyrimidyl)pyrrol-2-yl]methyl]pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Formula: C18H20N5OS+ MolecularWeight: 354.4493

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC2=CC=CN2C3=NC=CC=N3)C4=CC=C(S4)C(=O)N

Isomeric SMILES

C1C[C@@H]([NH+](C1)CC2=CC=CN2C3=NC=CC=N3)C4=CC=C(S4)C(=O)N

InChI

InChI=1S/C18H19N5OS/c19-17(24)16-7-6-15(25-16)14-5-2-10-22(14)12-13-4-1-11-23(13)18-20-8-3-9-21-18/h1,3-4,6-9,11,14H,2,5,10,12H2,(H2,19,24)/p+1/t14-/m1/s1