4-[2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]-1,4-benzothiazin-3-one

Systemtic Name: 4-[2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]-1,4-benzothiazin-3-one Openeye Name: 4-[2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]-1,4-benzothiazin-3-one CAS Name: 4-[2-oxo-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethyl]-1,4-benzothiazin-3-one IUPAC Name: 4-[2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]-1,4-benzothiazin-3-one Traditional Name: 4-[2-keto-2-(4-pyridin-1-ium-2-ylpiperazino)ethyl]-1,4-benzothiazin-3-one Formula: C19H21N4O2S+ MolecularWeight: 369.46064

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)CN3C(=O)CSC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)CN3C(=O)CSC4=CC=CC=C43

InChI

InChI=1S/C19H20N4O2S/c24-18(13-23-15-5-1-2-6-16(15)26-14-19(23)25)22-11-9-21(10-12-22)17-7-3-4-8-20-17/h1-8H,9-14H2/p+1