2-[(2S)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]-N-(1-propylpiperidin-1-ium-4-yl)ethanamide

Systemtic Name: 2-[(2S)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]-N-(1-propylpiperidin-1-ium-4-yl)ethanamide Openeye Name: 2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]-N-(1-propylpiperidin-1-ium-4-yl)acetamide CAS Name: 2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]-N-(1-propyl-4-piperidin-1-iumyl)acetamide IUPAC Name: 2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]-N-(1-propylpiperidin-1-ium-4-yl)acetamide Traditional Name: 2-[(2S)-3-keto-4H-1,4-benzothiazin-2-yl]-N-(1-propylpiperidin-1-ium-4-yl)acetamide Formula: C18H26N3O2S+ MolecularWeight: 348.48294

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC(=O)CC2C(=O)NC3=CC=CC=C3S2

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC(=O)C[C@H]2C(=O)NC3=CC=CC=C3S2

InChI

InChI=1S/C18H25N3O2S/c1-2-9-21-10-7-13(8-11-21)19-17(22)12-16-18(23)20-14-5-3-4-6-15(14)24-16/h3-6,13,16H,2,7-12H2,1H3,(H,19,22)(H,20,23)/p+1/t16-/m0/s1