N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-1,3-benzothiazole-6-carboxamide CAS Name: N-[2-methyl-2-(4-morpholin-4-iumyl)propyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2-methyl-2-morpholin-4-ium-4-ylpropyl)-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-1,3-benzothiazole-6-carboxamide Formula: C16H22N3O2S+ MolecularWeight: 320.42978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1=CC2=C(C=C1)N=CS2)[NH+]3CCOCC3

Isomeric SMILES

CC(C)(CNC(=O)C1=CC2=C(C=C1)N=CS2)[NH+]3CCOCC3

InChI

InChI=1S/C16H21N3O2S/c1-16(2,19-5-7-21-8-6-19)10-17-15(20)12-3-4-13-14(9-12)22-11-18-13/h3-4,9,11H,5-8,10H2,1-2H3,(H,17,20)/p+1