6-[4-[2-(4-fluorophenyl)ethanoyl]piperazin-1-yl]carbonyl-4H-1,4-benzothiazin-3-one

Systemtic Name: 6-[4-[2-(4-fluorophenyl)ethanoyl]piperazin-1-yl]carbonyl-4H-1,4-benzothiazin-3-one Openeye Name: 6-[4-[2-(4-fluorophenyl)acetyl]piperazine-1-carbonyl]-4H-1,4-benzothiazin-3-one CAS Name: 6-[[4-[2-(4-fluorophenyl)-1-oxoethyl]-1-piperazinyl]-oxomethyl]-4H-1,4-benzothiazin-3-one IUPAC Name: 6-[4-[2-(4-fluorophenyl)acetyl]piperazine-1-carbonyl]-4H-1,4-benzothiazin-3-one Traditional Name: 6-[4-[2-(4-fluorophenyl)acetyl]piperazine-1-carbonyl]-4H-1,4-benzothiazin-3-one Formula: C21H20FN3O3S MolecularWeight: 413.465203

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC2=CC=C(C=C2)F)C(=O)C3=CC4=C(C=C3)SCC(=O)N4

Isomeric SMILES

C1CN(CCN1C(=O)CC2=CC=C(C=C2)F)C(=O)C3=CC4=C(C=C3)SCC(=O)N4

InChI

InChI=1S/C21H20FN3O3S/c22-16-4-1-14(2-5-16)11-20(27)24-7-9-25(10-8-24)21(28)15-3-6-18-17(12-15)23-19(26)13-29-18/h1-6,12H,7-11,13H2,(H,23,26)