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

Systemtic Name: 6-[3-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanyl-propoxy]-4H-1,4-benzothiazin-3-one Openeye Name: 6-[3-[4-(4-fluorophenyl)piperazin-1-yl]-2-hydroxy-propoxy]-4H-1,4-benzothiazin-3-one CAS Name: 6-[3-[4-(4-fluorophenyl)-1-piperazinyl]-2-hydroxypropoxy]-4H-1,4-benzothiazin-3-one IUPAC Name: 6-[3-[4-(4-fluorophenyl)piperazin-1-yl]-2-hydroxypropoxy]-4H-1,4-benzothiazin-3-one Traditional Name: 6-[3-[4-(4-fluorophenyl)piperazino]-2-hydroxy-propoxy]-4H-1,4-benzothiazin-3-one Formula: C21H24FN3O3S MolecularWeight: 417.496963

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC3=C(C=C2)SCC(=O)N3)O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1CC(COC2=CC3=C(C=C2)SCC(=O)N3)O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H24FN3O3S/c22-15-1-3-16(4-2-15)25-9-7-24(8-10-25)12-17(26)13-28-18-5-6-20-19(11-18)23-21(27)14-29-20/h1-6,11,17,26H,7-10,12-14H2,(H,23,27)