3-oxidanylidene-2-pyrrolidin-1-ium-1-yl-N-(2-pyrrolidin-1-ium-1-ylethyl)-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: 3-oxidanylidene-2-pyrrolidin-1-ium-1-yl-N-(2-pyrrolidin-1-ium-1-ylethyl)-4H-1,4-benzothiazine-6-carboxamide Openeye Name: 3-oxo-2-pyrrolidin-1-ium-1-yl-N-(2-pyrrolidin-1-ium-1-ylethyl)-4H-1,4-benzothiazine-6-carboxamide CAS Name: 3-oxo-2-(1-pyrrolidin-1-iumyl)-N-[2-(1-pyrrolidin-1-iumyl)ethyl]-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: 3-oxo-2-pyrrolidin-1-ium-1-yl-N-(2-pyrrolidin-1-ium-1-ylethyl)-4H-1,4-benzothiazine-6-carboxamide Traditional Name: 3-keto-2-pyrrolidin-1-ium-1-yl-N-(2-pyrrolidin-1-ium-1-ylethyl)-4H-1,4-benzothiazine-6-carboxamide Formula: C19H28N4O2S+2 MolecularWeight: 376.51622

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCNC(=O)C2=CC3=C(C=C2)SC(C(=O)N3)[NH+]4CCCC4

Isomeric SMILES

C1CC[NH+](C1)CCNC(=O)C2=CC3=C(C=C2)SC(C(=O)N3)[NH+]4CCCC4

InChI

InChI=1S/C19H26N4O2S/c24-17(20-7-12-22-8-1-2-9-22)14-5-6-16-15(13-14)21-18(25)19(26-16)23-10-3-4-11-23/h5-6,13,19H,1-4,7-12H2,(H,20,24)(H,21,25)/p+2