(2R)-2-methyl-3-oxidanylidene-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: (2R)-2-methyl-3-oxidanylidene-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]-4H-1,4-benzothiazine-6-carboxamide Openeye Name: (2R)-2-methyl-3-oxo-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]-4H-1,4-benzothiazine-6-carboxamide CAS Name: (2R)-2-methyl-3-oxo-N-[[2-(1-pyrrolidinyl)-4-pyridin-1-iumyl]methyl]-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: (2R)-2-methyl-3-oxo-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]-4H-1,4-benzothiazine-6-carboxamide Traditional Name: (2R)-3-keto-2-methyl-N-[(2-pyrrolidinopyridin-1-ium-4-yl)methyl]-4H-1,4-benzothiazine-6-carboxamide Formula: C20H23N4O2S+ MolecularWeight: 383.48722

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(S1)C=CC(=C2)C(=O)NCC3=CC(=[NH+]C=C3)N4CCCC4

Isomeric SMILES

C[C@@H]1C(=O)NC2=C(S1)C=CC(=C2)C(=O)NCC3=CC(=[NH+]C=C3)N4CCCC4

InChI

InChI=1S/C20H22N4O2S/c1-13-19(25)23-16-11-15(4-5-17(16)27-13)20(26)22-12-14-6-7-21-18(10-14)24-8-2-3-9-24/h4-7,10-11,13H,2-3,8-9,12H2,1H3,(H,22,26)(H,23,25)/p+1/t13-/m1/s1