6-[1-oxidanyl-4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-4H-1,4-benzothiazin-3-one

Systemtic Name: 6-[1-oxidanyl-4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-4H-1,4-benzothiazin-3-one Openeye Name: 6-[1-hydroxy-4-[4-(2-pyridyl)piperazin-1-yl]butyl]-4H-1,4-benzothiazin-3-one CAS Name: 6-[1-hydroxy-4-[4-(2-pyridinyl)-1-piperazinyl]butyl]-4H-1,4-benzothiazin-3-one IUPAC Name: 6-[1-hydroxy-4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-4H-1,4-benzothiazin-3-one Traditional Name: 6-[1-hydroxy-4-[4-(2-pyridyl)piperazino]butyl]-4H-1,4-benzothiazin-3-one Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC(C2=CC3=C(C=C2)SCC(=O)N3)O)C4=CC=CC=N4

Isomeric SMILES

C1CN(CCN1CCCC(C2=CC3=C(C=C2)SCC(=O)N3)O)C4=CC=CC=N4

InChI

InChI=1S/C21H26N4O2S/c26-18(16-6-7-19-17(14-16)23-21(27)15-28-19)4-3-9-24-10-12-25(13-11-24)20-5-1-2-8-22-20/h1-2,5-8,14,18,26H,3-4,9-13,15H2,(H,23,27)