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

Systemtic Name: (2R)-2-methyl-3-oxidanylidene-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]-4H-1,4-benzothiazine-6-carboxamide Openeye Name: (2R)-2-methyl-3-oxo-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]-4H-1,4-benzothiazine-6-carboxamide CAS Name: (2R)-2-methyl-3-oxo-N-[(2S)-2-(1-pyrrolidin-1-iumyl)-2-thiophen-2-ylethyl]-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: (2R)-2-methyl-3-oxo-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-ylethyl]-4H-1,4-benzothiazine-6-carboxamide Traditional Name: (2R)-3-keto-2-methyl-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]-4H-1,4-benzothiazine-6-carboxamide Formula: C20H24N3O2S2+ MolecularWeight: 402.55346

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(S1)C=CC(=C2)C(=O)NCC(C3=CC=CS3)[NH+]4CCCC4

Isomeric SMILES

C[C@@H]1C(=O)NC2=C(S1)C=CC(=C2)C(=O)NC[C@@H](C3=CC=CS3)[NH+]4CCCC4

InChI

InChI=1S/C20H23N3O2S2/c1-13-19(24)22-15-11-14(6-7-17(15)27-13)20(25)21-12-16(18-5-4-10-26-18)23-8-2-3-9-23/h4-7,10-11,13,16H,2-3,8-9,12H2,1H3,(H,21,25)(H,22,24)/p+1/t13-,16+/m1/s1