6-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]carbonyl-4H-1,4-benzothiazin-3-one

Systemtic Name: 6-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]carbonyl-4H-1,4-benzothiazin-3-one Openeye Name: 6-[4-(5-chloro-2-fluoro-benzoyl)piperazine-1-carbonyl]-4H-1,4-benzothiazin-3-one CAS Name: 6-[[4-[(5-chloro-2-fluorophenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]-4H-1,4-benzothiazin-3-one IUPAC Name: 6-[4-(5-chloro-2-fluorobenzoyl)piperazine-1-carbonyl]-4H-1,4-benzothiazin-3-one Traditional Name: 6-[4-(5-chloro-2-fluoro-benzoyl)piperazine-1-carbonyl]-4H-1,4-benzothiazin-3-one Formula: C20H17ClFN3O3S MolecularWeight: 433.883683

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=C(C=C2)SCC(=O)N3)C(=O)C4=C(C=CC(=C4)Cl)F

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=C(C=C2)SCC(=O)N3)C(=O)C4=C(C=CC(=C4)Cl)F

InChI

InChI=1S/C20H17ClFN3O3S/c21-13-2-3-15(22)14(10-13)20(28)25-7-5-24(6-8-25)19(27)12-1-4-17-16(9-12)23-18(26)11-29-17/h1-4,9-10H,5-8,11H2,(H,23,26)