5-[(2R)-1-[(2,5-dimethyl-1-pyridin-3-yl-pyrrol-3-yl)methyl]pyrrolidin-1-ium-2-yl]-N-methyl-thiophene-2-carboxamide

Systemtic Name: 5-[(2R)-1-[(2,5-dimethyl-1-pyridin-3-yl-pyrrol-3-yl)methyl]pyrrolidin-1-ium-2-yl]-N-methyl-thiophene-2-carboxamide Openeye Name: 5-[(2R)-1-[[2,5-dimethyl-1-(3-pyridyl)pyrrol-3-yl]methyl]pyrrolidin-1-ium-2-yl]-N-methyl-thiophene-2-carboxamide CAS Name: 5-[(2R)-1-[[2,5-dimethyl-1-(3-pyridinyl)-3-pyrrolyl]methyl]-2-pyrrolidin-1-iumyl]-N-methyl-2-thiophenecarboxamide IUPAC Name: 5-[(2R)-1-[(2,5-dimethyl-1-pyridin-3-ylpyrrol-3-yl)methyl]pyrrolidin-1-ium-2-yl]-N-methylthiophene-2-carboxamide Traditional Name: 5-[(2R)-1-[[2,5-dimethyl-1-(3-pyridyl)pyrrol-3-yl]methyl]pyrrolidin-1-ium-2-yl]-N-methyl-thiophene-2-carboxamide Formula: C22H27N4OS+ MolecularWeight: 395.54098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CN=CC=C2)C)C[NH+]3CCCC3C4=CC=C(S4)C(=O)NC

Isomeric SMILES

CC1=CC(=C(N1C2=CN=CC=C2)C)C[NH+]3CCC[C@@H]3C4=CC=C(S4)C(=O)NC

InChI

InChI=1S/C22H26N4OS/c1-15-12-17(16(2)26(15)18-6-4-10-24-13-18)14-25-11-5-7-19(25)20-8-9-21(28-20)22(27)23-3/h4,6,8-10,12-13,19H,5,7,11,14H2,1-3H3,(H,23,27)/p+1/t19-/m1/s1