2-[(3-oxidanylidene-1,4-benzothiazin-4-yl)methyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)-1,3-oxazole-4-carboxamide

Systemtic Name: 2-[(3-oxidanylidene-1,4-benzothiazin-4-yl)methyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)-1,3-oxazole-4-carboxamide Openeye Name: 2-[(3-oxo-1,4-benzothiazin-4-yl)methyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)oxazole-4-carboxamide CAS Name: 2-[(3-oxo-1,4-benzothiazin-4-yl)methyl]-N-[2-(1-pyrrolidin-1-iumyl)ethyl]-4-oxazolecarboxamide IUPAC Name: 2-[(3-oxo-1,4-benzothiazin-4-yl)methyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)-1,3-oxazole-4-carboxamide Traditional Name: 2-[(3-keto-1,4-benzothiazin-4-yl)methyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)oxazole-4-carboxamide Formula: C19H23N4O3S+ MolecularWeight: 387.47592

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCNC(=O)C2=COC(=N2)CN3C(=O)CSC4=CC=CC=C43

Isomeric SMILES

C1CC[NH+](C1)CCNC(=O)C2=COC(=N2)CN3C(=O)CSC4=CC=CC=C43

InChI

InChI=1S/C19H22N4O3S/c24-18-13-27-16-6-2-1-5-15(16)23(18)11-17-21-14(12-26-17)19(25)20-7-10-22-8-3-4-9-22/h1-2,5-6,12H,3-4,7-11,13H2,(H,20,25)/p+1