N-(5,5-dimethyl-7-oxidanylidene-4,6-dihydro-1,3-benzothiazol-2-yl)-2-morpholin-4-ium-4-yl-ethanamide

Systemtic Name: N-(5,5-dimethyl-7-oxidanylidene-4,6-dihydro-1,3-benzothiazol-2-yl)-2-morpholin-4-ium-4-yl-ethanamide Openeye Name: N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-morpholin-4-ium-4-yl-acetamide CAS Name: N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-(4-morpholin-4-iumyl)acetamide IUPAC Name: N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-morpholin-4-ium-4-ylacetamide Traditional Name: N-(7-keto-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-2-yl)-2-morpholin-4-ium-4-yl-acetamide Formula: C15H22N3O3S+ MolecularWeight: 324.41848

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)SC(=N2)NC(=O)C[NH+]3CCOCC3)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)SC(=N2)NC(=O)C[NH+]3CCOCC3)C

InChI

InChI=1S/C15H21N3O3S/c1-15(2)7-10-13(11(19)8-15)22-14(16-10)17-12(20)9-18-3-5-21-6-4-18/h3-9H2,1-2H3,(H,16,17,20)/p+1