2-[4-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]butyl]-7-oxidanyl-4H-1,4-benzothiazin-3-one

Systemtic Name: 2-[4-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]butyl]-7-oxidanyl-4H-1,4-benzothiazin-3-one Openeye Name: 2-[4-[4-(4-fluorobenzoyl)piperazin-1-yl]butyl]-7-hydroxy-4H-1,4-benzothiazin-3-one CAS Name: 2-[4-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]butyl]-7-hydroxy-4H-1,4-benzothiazin-3-one IUPAC Name: 2-[4-[4-(4-fluorobenzoyl)piperazin-1-yl]butyl]-7-hydroxy-4H-1,4-benzothiazin-3-one Traditional Name: 2-[4-[4-(4-fluorobenzoyl)piperazino]butyl]-7-hydroxy-4H-1,4-benzothiazin-3-one Formula: C23H26FN3O3S MolecularWeight: 443.534243

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCC2C(=O)NC3=C(S2)C=C(C=C3)O)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1CCCCC2C(=O)NC3=C(S2)C=C(C=C3)O)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H26FN3O3S/c24-17-6-4-16(5-7-17)23(30)27-13-11-26(12-14-27)10-2-1-3-20-22(29)25-19-9-8-18(28)15-21(19)31-20/h4-9,15,20,28H,1-3,10-14H2,(H,25,29)