4-cyano-N-[(1R,2S)-1-pyrrolidin-1-ium-1-yl-1-thiophen-2-yl-propan-2-yl]benzamide

Systemtic Name: 4-cyano-N-[(1R,2S)-1-pyrrolidin-1-ium-1-yl-1-thiophen-2-yl-propan-2-yl]benzamide Openeye Name: 4-cyano-N-[(1S,2R)-1-methyl-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]benzamide CAS Name: 4-cyano-N-[(1R,2S)-1-(1-pyrrolidin-1-iumyl)-1-thiophen-2-ylpropan-2-yl]benzamide IUPAC Name: 4-cyano-N-[(1R,2S)-1-pyrrolidin-1-ium-1-yl-1-thiophen-2-ylpropan-2-yl]benzamide Traditional Name: 4-cyano-N-[(1S,2R)-1-methyl-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]benzamide Formula: C19H22N3OS+ MolecularWeight: 340.46248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CS1)[NH+]2CCCC2)NC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C[C@@H]([C@H](C1=CC=CS1)[NH+]2CCCC2)NC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H21N3OS/c1-14(21-19(23)16-8-6-15(13-20)7-9-16)18(17-5-4-12-24-17)22-10-2-3-11-22/h4-9,12,14,18H,2-3,10-11H2,1H3,(H,21,23)/p+1/t14-,18+/m0/s1