N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-morpholin-4-ium-4-yl-ethanamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-morpholin-4-ium-4-yl-ethanamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-morpholin-4-ium-4-yl-acetamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(4-morpholin-4-iumyl)acetamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-morpholin-4-ium-4-ylacetamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-morpholin-4-ium-4-yl-acetamide Formula: C13H15ClN3O2S+ MolecularWeight: 312.7951

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(=O)NC2=NC3=C(S2)C=C(C=C3)Cl

Isomeric SMILES

C1COCC[NH+]1CC(=O)NC2=NC3=C(S2)C=C(C=C3)Cl

InChI

InChI=1S/C13H14ClN3O2S/c14-9-1-2-10-11(7-9)20-13(15-10)16-12(18)8-17-3-5-19-6-4-17/h1-2,7H,3-6,8H2,(H,15,16,18)/p+1