6-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]carbonyl-4H-1,4-benzothiazin-3-one

Systemtic Name: 6-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]carbonyl-4H-1,4-benzothiazin-3-one Openeye Name: 6-[4-[5-(trifluoromethyl)-2-pyridyl]piperazine-1-carbonyl]-4H-1,4-benzothiazin-3-one CAS Name: 6-[oxo-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]methyl]-4H-1,4-benzothiazin-3-one IUPAC Name: 6-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carbonyl]-4H-1,4-benzothiazin-3-one Traditional Name: 6-[4-[5-(trifluoromethyl)-2-pyridyl]piperazine-1-carbonyl]-4H-1,4-benzothiazin-3-one Formula: C19H17F3N4O2S MolecularWeight: 422.42409

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C(=O)C3=CC4=C(C=C3)SCC(=O)N4

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C(=O)C3=CC4=C(C=C3)SCC(=O)N4

InChI

InChI=1S/C19H17F3N4O2S/c20-19(21,22)13-2-4-16(23-10-13)25-5-7-26(8-6-25)18(28)12-1-3-15-14(9-12)24-17(27)11-29-15/h1-4,9-10H,5-8,11H2,(H,24,27)