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

Systemtic Name: N-[(S)-(4-methylphenyl)-thiophen-2-yl-methyl]-2-morpholin-4-ium-4-yl-ethanamide Openeye Name: 2-morpholin-4-ium-4-yl-N-[(S)-p-tolyl(2-thienyl)methyl]acetamide CAS Name: N-[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]-2-(4-morpholin-4-iumyl)acetamide IUPAC Name: N-[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]-2-morpholin-4-ium-4-ylacetamide Traditional Name: 2-morpholin-4-ium-4-yl-N-[(S)-p-tolyl(2-thienyl)methyl]acetamide Formula: C18H23N2O2S+ MolecularWeight: 331.45242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C[NH+]3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](C2=CC=CS2)NC(=O)C[NH+]3CCOCC3

InChI

InChI=1S/C18H22N2O2S/c1-14-4-6-15(7-5-14)18(16-3-2-12-23-16)19-17(21)13-20-8-10-22-11-9-20/h2-7,12,18H,8-11,13H2,1H3,(H,19,21)/p+1/t18-/m0/s1