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

Systemtic Name: 6-[3-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-2-oxidanyl-propoxy]-4H-1,4-benzothiazin-3-one Openeye Name: 6-[3-[4-(4-fluorobenzoyl)piperazin-1-yl]-2-hydroxy-propoxy]-4H-1,4-benzothiazin-3-one CAS Name: 6-[3-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]-2-hydroxypropoxy]-4H-1,4-benzothiazin-3-one IUPAC Name: 6-[3-[4-(4-fluorobenzoyl)piperazin-1-yl]-2-hydroxypropoxy]-4H-1,4-benzothiazin-3-one Traditional Name: 6-[3-[4-(4-fluorobenzoyl)piperazino]-2-hydroxy-propoxy]-4H-1,4-benzothiazin-3-one Formula: C22H24FN3O4S MolecularWeight: 445.507063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24FN3O4S/c23-16-3-1-15(2-4-16)22(29)26-9-7-25(8-10-26)12-17(27)13-30-18-5-6-20-19(11-18)24-21(28)14-31-20/h1-6,11,17,27H,7-10,12-14H2,(H,24,28)