N-ethyl-N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-2-[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-ethyl-N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-2-[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-ethyl-N-[(3-fluoro-4-methoxy-phenyl)methyl]-2-(4-thiazol-2-ylpiperazin-1-ium-1-yl)acetamide CAS Name: N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-2-[4-(2-thiazolyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-2-[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-ethyl-N-(3-fluoro-4-methoxy-benzyl)-2-(4-thiazol-2-ylpiperazin-1-ium-1-yl)acetamide Formula: C19H26FN4O2S+ MolecularWeight: 393.498743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OC)F)C(=O)C[NH+]2CCN(CC2)C3=NC=CS3

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OC)F)C(=O)C[NH+]2CCN(CC2)C3=NC=CS3

InChI

InChI=1S/C19H25FN4O2S/c1-3-23(13-15-4-5-17(26-2)16(20)12-15)18(25)14-22-7-9-24(10-8-22)19-21-6-11-27-19/h4-6,11-12H,3,7-10,13-14H2,1-2H3/p+1