4-(dimethylamino)-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]benzamide

Systemtic Name: 4-(dimethylamino)-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]benzamide Openeye Name: 4-(dimethylamino)-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]benzamide CAS Name: 4-(dimethylamino)-N-[(2S)-2-(1-pyrrolidin-1-iumyl)-2-thiophen-2-ylethyl]benzamide IUPAC Name: 4-(dimethylamino)-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-ylethyl]benzamide Traditional Name: 4-(dimethylamino)-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]benzamide Formula: C19H26N3OS+ MolecularWeight: 344.49424

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(=O)NCC(C2=CC=CS2)[NH+]3CCCC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(=O)NC[C@@H](C2=CC=CS2)[NH+]3CCCC3

InChI

InChI=1S/C19H25N3OS/c1-21(2)16-9-7-15(8-10-16)19(23)20-14-17(18-6-5-13-24-18)22-11-3-4-12-22/h5-10,13,17H,3-4,11-12,14H2,1-2H3,(H,20,23)/p+1/t17-/m0/s1