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

Systemtic Name: N-[3-(4-methyl-5-phenyl-1,3-thiazol-2-yl)phenyl]-2-morpholin-4-ium-4-yl-ethanamide Openeye Name: N-[3-(4-methyl-5-phenyl-thiazol-2-yl)phenyl]-2-morpholin-4-ium-4-yl-acetamide CAS Name: N-[3-(4-methyl-5-phenyl-2-thiazolyl)phenyl]-2-(4-morpholin-4-iumyl)acetamide IUPAC Name: N-[3-(4-methyl-5-phenyl-1,3-thiazol-2-yl)phenyl]-2-morpholin-4-ium-4-ylacetamide Traditional Name: N-[3-(4-methyl-5-phenyl-thiazol-2-yl)phenyl]-2-morpholin-4-ium-4-yl-acetamide Formula: C22H24N3O2S+ MolecularWeight: 394.50986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC(=CC=C2)NC(=O)C[NH+]3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(SC(=N1)C2=CC(=CC=C2)NC(=O)C[NH+]3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N3O2S/c1-16-21(17-6-3-2-4-7-17)28-22(23-16)18-8-5-9-19(14-18)24-20(26)15-25-10-12-27-13-11-25/h2-9,14H,10-13,15H2,1H3,(H,24,26)/p+1