N-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-2-morpholin-4-ium-4-yl-ethanamide

Systemtic Name: N-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-2-morpholin-4-ium-4-yl-ethanamide Openeye Name: N-[4-(2,5-dimethylphenyl)thiazol-2-yl]-2-morpholin-4-ium-4-yl-acetamide CAS Name: N-[4-(2,5-dimethylphenyl)-2-thiazolyl]-2-(4-morpholin-4-iumyl)acetamide IUPAC Name: N-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-2-morpholin-4-ium-4-ylacetamide Traditional Name: N-[4-(2,5-dimethylphenyl)thiazol-2-yl]-2-morpholin-4-ium-4-yl-acetamide Formula: C17H22N3O2S+ MolecularWeight: 332.44048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=CSC(=N2)NC(=O)C[NH+]3CCOCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=CSC(=N2)NC(=O)C[NH+]3CCOCC3

InChI

InChI=1S/C17H21N3O2S/c1-12-3-4-13(2)14(9-12)15-11-23-17(18-15)19-16(21)10-20-5-7-22-8-6-20/h3-4,9,11H,5-8,10H2,1-2H3,(H,18,19,21)/p+1