N-(1,3-benzothiazol-2-yl)-2-(4-methoxyphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(4-methoxyphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(4-methoxyphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-(4-methoxyphenyl)-N-[3-(4-morpholin-4-iumyl)propyl]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(4-methoxyphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-(4-methoxyphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Formula: C23H28N3O3S+ MolecularWeight: 426.55172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)N(CCC[NH+]2CCOCC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)N(CCC[NH+]2CCOCC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H27N3O3S/c1-28-19-9-7-18(8-10-19)17-22(27)26(12-4-11-25-13-15-29-16-14-25)23-24-20-5-2-3-6-21(20)30-23/h2-3,5-10H,4,11-17H2,1H3/p+1