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

Systemtic Name: N-[4-(4-cyclohexylphenyl)-1,3-thiazol-2-yl]-2-morpholin-4-ium-4-yl-ethanamide Openeye Name: N-[4-(4-cyclohexylphenyl)thiazol-2-yl]-2-morpholin-4-ium-4-yl-acetamide CAS Name: N-[4-(4-cyclohexylphenyl)-2-thiazolyl]-2-(4-morpholin-4-iumyl)acetamide IUPAC Name: N-[4-(4-cyclohexylphenyl)-1,3-thiazol-2-yl]-2-morpholin-4-ium-4-ylacetamide Traditional Name: N-[4-(4-cyclohexylphenyl)thiazol-2-yl]-2-morpholin-4-ium-4-yl-acetamide Formula: C21H28N3O2S+ MolecularWeight: 386.53092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)C3=CSC(=N3)NC(=O)C[NH+]4CCOCC4

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)C3=CSC(=N3)NC(=O)C[NH+]4CCOCC4

InChI

InChI=1S/C21H27N3O2S/c25-20(14-24-10-12-26-13-11-24)23-21-22-19(15-27-21)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h6-9,15-16H,1-5,10-14H2,(H,22,23,25)/p+1