N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-2-(2-phenyl-1,3-thiazol-4-yl)ethanamide

Systemtic Name: N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-2-(2-phenyl-1,3-thiazol-4-yl)ethanamide Openeye Name: N-[(6-morpholinopyridin-1-ium-3-yl)methyl]-2-(2-phenylthiazol-4-yl)acetamide CAS Name: N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-2-(2-phenyl-4-thiazolyl)acetamide IUPAC Name: N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide Traditional Name: N-[(6-morpholinopyridin-1-ium-3-yl)methyl]-2-(2-phenylthiazol-4-yl)acetamide Formula: C21H23N4O2S+ MolecularWeight: 395.49792

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)CC3=CSC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)CC3=CSC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4O2S/c26-20(12-18-15-28-21(24-18)17-4-2-1-3-5-17)23-14-16-6-7-19(22-13-16)25-8-10-27-11-9-25/h1-7,13,15H,8-12,14H2,(H,23,26)/p+1