N-[4,5-dimethyl-3-(4-methylphenyl)carbonyl-thiophen-2-yl]-2-morpholin-4-ium-4-yl-ethanamide

Systemtic Name: N-[4,5-dimethyl-3-(4-methylphenyl)carbonyl-thiophen-2-yl]-2-morpholin-4-ium-4-yl-ethanamide Openeye Name: N-[4,5-dimethyl-3-(4-methylbenzoyl)-2-thienyl]-2-morpholin-4-ium-4-yl-acetamide CAS Name: N-[4,5-dimethyl-3-[(4-methylphenyl)-oxomethyl]-2-thiophenyl]-2-(4-morpholin-4-iumyl)acetamide IUPAC Name: N-[4,5-dimethyl-3-(4-methylbenzoyl)thiophen-2-yl]-2-morpholin-4-ium-4-ylacetamide Traditional Name: N-(4,5-dimethyl-3-p-toluoyl-2-thienyl)-2-morpholin-4-ium-4-yl-acetamide Formula: C20H25N2O3S+ MolecularWeight: 373.4891

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=C(SC(=C2C)C)NC(=O)C[NH+]3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=C(SC(=C2C)C)NC(=O)C[NH+]3CCOCC3

InChI

InChI=1S/C20H24N2O3S/c1-13-4-6-16(7-5-13)19(24)18-14(2)15(3)26-20(18)21-17(23)12-22-8-10-25-11-9-22/h4-7H,8-12H2,1-3H3,(H,21,23)/p+1