7-[4-[2-(5-chloranyl-1-benzothiophen-3-yl)ethyl]piperazin-1-yl]-5-fluoranyl-3-methyl-1,3-benzoxazol-2-one

Systemtic Name: 7-[4-[2-(5-chloranyl-1-benzothiophen-3-yl)ethyl]piperazin-1-yl]-5-fluoranyl-3-methyl-1,3-benzoxazol-2-one Openeye Name: 7-[4-[2-(5-chlorobenzothiophen-3-yl)ethyl]piperazin-1-yl]-5-fluoro-3-methyl-1,3-benzoxazol-2-one CAS Name: 7-[4-[2-(5-chloro-1-benzothiophen-3-yl)ethyl]-1-piperazinyl]-5-fluoro-3-methyl-1,3-benzoxazol-2-one IUPAC Name: 7-[4-[2-(5-chloro-1-benzothiophen-3-yl)ethyl]piperazin-1-yl]-5-fluoro-3-methyl-1,3-benzoxazol-2-one Traditional Name: 7-[4-[2-(5-chlorobenzothiophen-3-yl)ethyl]piperazino]-5-fluoro-3-methyl-1,3-benzoxazol-2-one Formula: C22H21ClFN3O2S MolecularWeight: 445.937443

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC(=CC(=C2OC1=O)N3CCN(CC3)CCC4=CSC5=C4C=C(C=C5)Cl)F

Isomeric SMILES

CN1C2=CC(=CC(=C2OC1=O)N3CCN(CC3)CCC4=CSC5=C4C=C(C=C5)Cl)F

InChI

InChI=1S/C22H21ClFN3O2S/c1-25-18-11-16(24)12-19(21(18)29-22(25)28)27-8-6-26(7-9-27)5-4-14-13-30-20-3-2-15(23)10-17(14)20/h2-3,10-13H,4-9H2,1H3