[4-(4-ethylphenyl)-3H-1,3-thiazol-2-ylidene]-(2-morpholin-4-ylpyridin-3-yl)carbonyl-azanium

Systemtic Name: [4-(4-ethylphenyl)-3H-1,3-thiazol-2-ylidene]-(2-morpholin-4-ylpyridin-3-yl)carbonyl-azanium Openeye Name: [4-(4-ethylphenyl)-3H-thiazol-2-ylidene]-(2-morpholinopyridine-3-carbonyl)ammonium CAS Name: [4-(4-ethylphenyl)-3H-thiazol-2-ylidene]-[[2-(4-morpholinyl)-3-pyridinyl]-oxomethyl]ammonium IUPAC Name: [4-(4-ethylphenyl)-3H-1,3-thiazol-2-ylidene]-(2-morpholin-4-ylpyridine-3-carbonyl)azanium Traditional Name: [4-(4-ethylphenyl)-4-thiazolin-2-ylidene]-(2-morpholinonicotinoyl)ammonium Formula: C21H23N4O2S+ MolecularWeight: 395.49792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=[NH+]C(=O)C3=C(N=CC=C3)N4CCOCC4)N2

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=[NH+]C(=O)C3=C(N=CC=C3)N4CCOCC4)N2

InChI

InChI=1S/C21H22N4O2S/c1-2-15-5-7-16(8-6-15)18-14-28-21(23-18)24-20(26)17-4-3-9-22-19(17)25-10-12-27-13-11-25/h3-9,14H,2,10-13H2,1H3,(H,23,24,26)/p+1