2,5-dimethyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]thiophene-3-carboxamide

Systemtic Name: 2,5-dimethyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]thiophene-3-carboxamide Openeye Name: 2,5-dimethyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]thiophene-3-carboxamide CAS Name: 2,5-dimethyl-N-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-3-thiophenecarboxamide IUPAC Name: 2,5-dimethyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]thiophene-3-carboxamide Traditional Name: 2,5-dimethyl-N-[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]thiophene-3-carboxamide Formula: C19H25N2OS+ MolecularWeight: 329.4796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)NCC2=CC=CC=C2C[NH+]3CCCC3

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)NCC2=CC=CC=C2C[NH+]3CCCC3

InChI

InChI=1S/C19H24N2OS/c1-14-11-18(15(2)23-14)19(22)20-12-16-7-3-4-8-17(16)13-21-9-5-6-10-21/h3-4,7-8,11H,5-6,9-10,12-13H2,1-2H3,(H,20,22)/p+1