N-[(S)-(4-methylphenyl)-thiophen-2-yl-methyl]-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[(S)-(4-methylphenyl)-thiophen-2-yl-methyl]-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-[(S)-p-tolyl(2-thienyl)methyl]-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-[(S)-p-tolyl(2-thienyl)methyl]-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C18H23N2OS+ MolecularWeight: 315.45302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C[NH+]3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](C2=CC=CS2)NC(=O)C[NH+]3CCCC3

InChI

InChI=1S/C18H22N2OS/c1-14-6-8-15(9-7-14)18(16-5-4-12-22-16)19-17(21)13-20-10-2-3-11-20/h4-9,12,18H,2-3,10-11,13H2,1H3,(H,19,21)/p+1/t18-/m0/s1